Virtually screened ligands of Decoy

ZINC ID:
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Rank Zinc_Id Compound Delta_G Mol_wt ES Vdw Desolv RotBond Availability
120254485
 N-(2-aminoethyl)pyrrolidine-1-sulfonamide		-62.65194.280-61.86-0.58p=-0.49, ap=0.28
4
UORSY BB Make-on-demand:BBV-32186683
Enamine BB Make on Demand:BBV-32186683
219583674
 MFCD01025468		-62.24222.266-67.150.80p=3.77, ap=0.34
3
UORSY BB Make-on-demand:BBV-191909
Matrix Scientific:021445
319583672
 MFCD01025468		-61.18222.266-86.2622.01p=2.95, ap=0.11
3
UORSY BB Make-on-demand:BBV-191909
Matrix Scientific:021445
42179235
 N-(3-fluorophenyl)-N-(methylsulfonyl)glycine		-47.68246.239-54.38-9.33p=17.10, ap=-1.06
4
Specs:AO-081/41757040
Vitas-M:STK172231
Pharmeks:PHAR267673
ChemBridge BuildingBlocks:7618321
ChemBridge:7618321
Ark Pharm Building Blocks:AK108697
eMolecules:1736830
Princeton BioMolecular Research:OSSK_568210
521969040
 5-chloro-2-methanesulfonamidobenzoic acid		-47.08248.667-45.56-14.40p=14.13, ap=-1.25
3
Enamine Building Blocks:EN300-60480
UORSY BB Make-on-demand:BBV-011864
eMolecules:31414345
Molport:MolPort-004-295-136
Chembo Pharma:KB-112917
Tractus:TRA0069920
Enamine:Z55953121
Enamine BB Make on Demand:BBV-011864
682312369
 2-[3-(carboxymethyloxy)indazol-1-yl]acetic		-46.61248.194-47.96-14.23p=17.61, ap=-2.03
5
NA
782943563
 (3R)-3-amino-3-(5-methyl-7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-45.96208.221-42.81-16.20p=15.32, ap=-2.26
3
NA
882659213
 3-[4-fluoro-3-(5-methylimidazol-1-yl)phenyl]propanoic		-45.83248.257-40.68-18.49p=16.31, ap=-2.98
4
NA
982931739
 (3S)-3-amino-3-(1H-imidazo[4,5-c]pyridin-2-yl)propanoic		-45.71205.197-47.65-14.97p=17.41, ap=-0.49
3
NA
10122972
 MFCD02081803		-45.61246.246-44.77-19.23p=20.13, ap=-1.74
4
Asinex:BAS01911737
Molport BB:MolPort-000-653-027
ChemBridge:6135191
eMolecules:1355955
TimTec:ST50011051
Zylexa Pharma BB:ZP-BB-TV000172
eMolecules:2767892
Princeton BioMolecular Research:OSSL_135457
1183376389
 (3R)-3-amino-4-[(2-cyanophenyl)methylamino]-4-oxo-butanoic		-45.22247.254-34.74-15.76p=6.43, ap=-1.15
5
NA
12379134
 N-(4-Fluorophenyl)-N-(methylsulfonyl)glycine		-45.03246.239-47.75-10.56p=14.12, ap=-0.84
4
Asinex:BAS02208238
Matrix Scientific:011823
Pharmeks:PHAR273763
TimTec:ST50262198
Vitas-M:STK318686
ChemBridge:6232172
Labotest:LT00797972
eMolecules:1379066
1382931737
 (3S)-3-amino-3-(1H-imidazo[4,5-b]pyridin-2-yl)propanoic		-44.86205.197-46.09-15.64p=17.33, ap=-0.45
3
NA
1482659064
 3-(3-imidazol-1-yl-4-methoxy-phenyl)propanoic		-44.69245.258-38.58-19.28p=15.60, ap=-2.43
5
NA
1572266116
 1-(Carboxymethyl)-L-histidine		-44.63212.185-51.31-6.98p=14.96, ap=-1.30
5
Tyger Building Blocks:C90130
1682289289
 3-methyl-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazine-6-carbonitrile		-44.54221.241-36.84-12.72p=6.03, ap=-1.01
0
NA
1735688524
 2-(1,1-dioxo-2,3-dihydro-1$l^{6}-benzothiophen-3-yl)acetic acid		-44.41225.245-47.28-8.96p=13.13, ap=-1.30
2
Molport:MolPort-015-105-203
Molport BB:MolPort-015-105-203
Enamine Building Blocks:EN300-195456
1896331669
 2-methyl-2-[(6-oxo-1,7-dihydropurin-2-yl)amino]propanoic		-44.40236.211-39.40-17.28p=13.15, ap=-0.87
3
NA
1957534982
 (3R)-3-amino-4-(1-naphthyloxy)butanoic		-44.39245.278-32.65-17.97p=8.86, ap=-2.62
5
NA
2083367755
 (3R)-3-amino-4-[(3-fluorophenyl)methylamino]-4-oxo-butanoic		-44.39239.226-35.81-16.16p=9.42, ap=-1.83
5
UORSY BB Make-on-demand:BBV-39452681
Enamine BB Make on Demand:BBV-39452681
2183010209
 LS-33139		-44.32219.244-33.44-15.62p=6.64, ap=-1.90
4
NA
2276678900
 (8S)-5-oxo-6,7,8,9-tetrahydropyrido[BLAH:BLAH]pyrrolo[BLAH]pyrimidine-8-carboxylic		-44.30231.191-38.50-19.45p=15.00, ap=-1.35
1
NA
2382363600
 (2S)-2-amino-3-(3,5-dimethyl-7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-44.26222.248-31.98-16.84p=7.15, ap=-2.60
3
NA
2439121628
 Benzoic acid, 3-[(aminosulfonyl)amino]-, ethyl ester (9CI)		-44.25243.264-34.50-17.26p=9.28, ap=-1.77
5
Chemstep:77630
Chembo Pharma:KB-296616
2576684332
 (2S,3R)-2-amino-3-(4-fluoro-1H-indol-2-yl)-3-hydroxy-propanoic		-44.25238.218-32.36-17.04p=7.16, ap=-2.01
3
NA
2683353101
 (3R)-3-amino-4-oxo-4-(pyrimidin-5-ylmethylamino)butanoic		-44.24224.220-33.48-16.31p=6.42, ap=-0.87
5
NA
2783333653
 (2R)-3-amino-2-(7-fluoro-2-quinolyl)propanoic		-44.23234.230-33.88-17.09p=8.55, ap=-1.81
3
NA
2820230398
 3-[acetyl-(4-chlorophenyl)amino]propanoic		-44.20240.666-38.85-16.78p=13.53, ap=-2.10
4
NA
2962059
 2-[(3-carboxypropanoyl)amino]benzoic acid		-44.14235.195-54.56-13.61p=25.46, ap=-1.43
5
Chemical Block:A1069/0050149
Innovapharm BB Make on Demand:BBV-00035469
Vitas-M:STK246332
Aldrich CPR:S953687
ALDRICH
Innovapharm Make-on-Demand:VT-00204280
ChemBridge:5222415
FineTech:FT-0629213
TimTec:ST4023322
3077010949
 (2S)-2-[3-(hydroxymethyl)-5-methoxy-indol-1-yl]propanoic		-44.14248.258-37.19-19.37p=14.17, ap=-1.74
4
NA
3183020299
 (3R)-3-(3-methyl-7H-imidazo[1,2-a]imidazol-6-yl)pentanoic		-44.13220.252-38.23-16.53p=13.49, ap=-2.86
4
NA
3282741368
 (2R)-2-(3H-[1,2,4]triazolo[1,5-a]benzimidazol-2-ylamino)propanoic		-44.11244.234-34.23-20.14p=13.64, ap=-3.37
3
NA
3382961227
 (3R)-3-amino-4-oxo-4-(2-thienylmethylamino)butanoic		-44.10228.273-33.28-15.17p=5.91, ap=-1.57
5
UORSY BB Make-on-demand:BBV-39239632
Enamine BB Make on Demand:BBV-39239632
3439135800
 2-[(3-fluoro-2-hydroxy-benzoyl)amino]-2-methyl-propanoic		-44.09240.210-40.93-16.30p=13.74, ap=-0.60
3
NA
3533468947
 3-(3-isopropyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propanoic		-44.03239.280-36.38-20.64p=14.82, ap=-1.83
4
NA
3683365523
 (3R)-3-amino-4-[(2-amino-3-pyridyl)methylamino]-4-oxo-butanoic		-44.03237.239-34.31-19.31p=9.73, ap=-0.14
5
NA
3740911688
 2-methyl-2-(3-pyridylcarbamoylamino)propanoic		-43.97222.224-39.89-17.85p=14.66, ap=-0.89
3
UORSY BB Make-on-demand:BBV-32617177
Enamine BB Make on Demand:BBV-32617177
3876678061
 (5S)-2-oxoBLAH-5-carboxylic		-43.78230.203-39.14-19.60p=16.21, ap=-1.25
1
NA
39117183
 4-[(3-cyano-2-thienyl)amino]-4-oxo-butanoic		-43.74223.233-45.20-14.36p=17.08, ap=-1.26
4
UORSY BB Make-on-demand:BBV-25152342
Enamine BB Make on Demand:BBV-25152342
4033466386
 3-(3-cyclopropyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propanoic		-43.72237.264-37.11-19.73p=15.03, ap=-1.91
4
NA
4182539369
 (3R)-3-amino-4-oxo-4-(4-pyridylmethylamino)butanoic		-43.69223.232-34.46-15.71p=7.32, ap=-0.85
5
UORSY BB Make-on-demand:BBV-39239620
Enamine BB Make on Demand:BBV-39239620
42122956
 2-(6-Methyl-quinazolin-4-ylamino)-butyric acidhydrochloride		-43.68244.274-40.42-19.95p=18.92, ap=-2.23
4
Asinex:BAS01911732
Zylexa Pharma BB:ZP-BB-TV000169
Matrix Scientific:010193
Molport:MolPort-001-906-313
Tractus:TRA0102602
TimTec:ST50011050
AKOS:AKOS015844602
Ambinter:Amb4324607
4340733
 2-[2-(3-methylphenoxy)acetyl]aminopropanoic		-43.64236.247-38.73-18.33p=15.60, ap=-2.17
5
Innovapharm BB Make on Demand:BBV-00018780
Innovapharm Building Blocks:BBS-00007618
ChemBridge:5528217
Innovapharm:STT-00209245
Princeton BioMolecular Research:OSSK_008875
ChemDiv:1683-0903
eMolecules:1852924
UORSY BB Make-on-demand:BBV-32447991
4483040704
 (3S)-4-amino-3-(5-methylimidazo[2,1-b]oxazol-2-yl)butanoic		-43.58223.232-33.51-17.45p=8.07, ap=-0.69
4
NA
4596265409
 (2R)-2-[(7-methoxyquinazolin-4-yl)amino]propanoic		-43.56246.246-39.18-21.47p=18.99, ap=-1.90
4
NA
4675973780
 (2S)-2-[2-(cyanomethyl)-5-fluoro-benzimidazol-1-yl]propanoic		-43.53246.221-35.44-16.93p=11.21, ap=-2.37
3
NA
4783009790
 (2R)-3-amino-2-(3-methylimidazo[1,2-a]pyridin-7-yl)propanoic		-43.53220.252-33.75-18.18p=10.54, ap=-2.14
3
NA
4882893886
 (3R)-3-amino-3-(7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-43.52193.186-41.52-15.33p=15.69, ap=-2.36
3
NA
4936150159
 3-(3-propyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propanoic		-43.48239.280-36.18-20.19p=14.99, ap=-2.09
5
NA
5060885045
 N-[2-(ethylamino)-2-oxo-ethyl]imidazo[1,2-a]pyrimidine-2-carboxamide		-43.48247.258-24.59-25.82p=9.11, ap=-2.19
4
NA
5183051222
 (2S)-2-amino-3-(2,5-dimethyl-7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-43.48223.256-32.36-15.69p=7.20, ap=-2.64
3
NA
5240500327
 2-(1,1-dioxobenzo[e][1,2,4]thiadiazin-2-yl)acetic		-43.47239.232-48.77-6.64p=12.99, ap=-1.04
2
Enamine BB Make on Demand:BBV-32519735
5383370863
 4-[(6-chloro-5-methyl-3-pyridyl)amino]-4-oxo-butanoic		-43.44241.654-35.50-19.61p=12.88, ap=-1.21
4
NA
5483051209
 (3R)-3-amino-3-(3,5-dimethyl-7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-43.43221.240-41.29-14.97p=15.08, ap=-2.24
3
NA
5582548335
 (3R)-3-amino-4-(3,4-dimethylanilino)-4-oxo-butanoic		-43.34236.271-29.04-17.05p=4.61, ap=-1.85
4
UORSY BB Make-on-demand:BBV-39452641
Enamine BB Make on Demand:BBV-39452641
5634084850
 2-[3-(4-methylbenzoyl)isoxazol-5-yl]acetic		-43.33244.226-35.38-21.11p=14.95, ap=-1.80
4
NA
5736157419
 4-(2-cyano-3-fluoro-anilino)-4-oxo-butanoic		-43.32235.194-42.91-13.67p=15.04, ap=-1.77
4
UORSY BB Make-on-demand:BBV-25208327
Enamine BB Make on Demand:BBV-25208327
5834084844
 2-[3-(4-fluorobenzoyl)isoxazol-5-yl]acetic		-43.30248.189-33.78-21.38p=13.59, ap=-1.73
4
NA
5937657338
 2-[isopropylsulfonyl(methyl)amino]acetic		-43.29194.232-52.35-4.53p=13.69, ap=-0.09
4
UORSY BB Make-on-demand:BBV-32063839
Enamine BB Make on Demand:BBV-32063839
6022210146
 4-fluoro-2-methanesulfonamidobenzoic acid		-43.24232.212-41.11-12.78p=11.53, ap=-0.88
3
eMolecules:27370060
UORSY BB Make-on-demand:BBV-027013
Enamine BB Make on Demand:BBV-027013
Molport:MolPort-004-305-303
Enamine Building Blocks:EN300-42770
Enamine:Z133867060
Molport BB:MolPort-004-305-303
Ark Pharm Building Blocks:AK-83919
6183365567
 4-[(3-cyano-5-methyl-2-thienyl)amino]-4-oxo-butanoic		-43.23238.268-45.26-13.44p=16.92, ap=-1.46
4
NA
625258825
 2-dimethylamino-4-oxo-4-(3-pyridylamino)butanoic		-43.21237.259-29.88-18.46p=6.01, ap=-0.88
5
Innovapharm:STT-00366798
Ambinter:Amb3279551
TimTec Make-on-Demand:ST51071392
AKOS:AKOS005143324
6327847322
 (2R)-3-amino-2-(6-chloro-1H-indol-3-yl)propanoic		-43.17238.674-30.90-18.27p=8.22, ap=-2.22
3
NA
6457525601
 (3S)-3-amino-4-indan-5-yloxy-butanoic		-43.10234.275-34.76-13.09p=6.83, ap=-2.07
5
NA
6536150161
 3-[3-(methoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]propanoic		-43.08241.252-37.29-18.51p=14.12, ap=-1.40
5
NA
6682312175
 3-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanoic		-43.06248.287-38.20-21.17p=18.45, ap=-2.15
5
NA
678700664
 (2S,3S)-3-Amino-3-(3,5-dimethoxyphenyl)-2-hydroxypropanoic acid		-43.05241.243-39.43-13.64p=9.79, ap=0.22
5
PepTech:TL680-1
Zylexa Pharma BB:ZP-BB-PT001613
Ark Pharm Building Blocks:AK119181
ChemMol:97602108
Chembo Pharma:KB-206692
AK Scientific:6623AC
6883020254
 (2S)-3-(3,5-dimethyl-7H-imidazo[1,2-a]imidazol-6-yl)-2-methyl-propanoic		-43.05220.252-35.97-18.03p=13.73, ap=-2.78
3
NA
6982309511
 (2S,3S)-3-amino-2-hydroxy-4-(1-naphthyl)butanoic		-43.04245.278-31.99-18.95p=10.49, ap=-2.59
4
NA
708700604
 (2S,3S)-3-Amino-2-hydroxy-3-(3-(trifluoromethyl)phenyl)propanoic acid		-43.03249.188-38.85-12.45p=9.40, ap=-1.14
4
PepTech:TL260-1
Zylexa Pharma BB:ZP-BB-PT001553
Ark Pharm Building Blocks:AK119126
ChemMol:97601999
Chembo Pharma:KB-206679
AK Scientific:6656AC
7176161220
 (2R)-2-amino-3-(5-hydroxy-1-methyl-benzimidazol-2-yl)propanoic		-43.03234.235-34.77-18.17p=9.53, ap=0.38
3
NA
7219965597
 (2S)-1-sulfamoylindoline-2-carboxylic		-43.02241.248-46.94-8.94p=14.06, ap=-1.20
2
NA
7357535487
 (3R)-3-amino-4-(8-quinolyloxy)butanoic		-43.02245.258-32.77-19.87p=11.40, ap=-1.78
5
NA
7474039004
 1-methoxy-4-methyl-2-[(1S)-1-(sulfamoylamino)ethyl]benzene		-43.01244.316-33.43-14.39p=6.31, ap=-1.50
4
NA
7537757076
 (2S)-2-[(1-oxo-2H-isoquinolin-3-yl)amino]propanoic		-43.00231.231-39.63-17.38p=14.91, ap=-0.90
3
UORSY BB Make-on-demand:BBV-32124410
Enamine BB Make on Demand:BBV-32124410
7613347371
 (2S,3'S)-alpha-Amino-2-carboxy-5-oxo-1-pyrrolidinebutanoic acid		-42.98229.212-48.52-13.40p=19.73, ap=-0.79
5
NA
7766141479
 acetic acid, [4-(4,5-dimethyl-1H-imidazol-2-yl)phenoxy]-		-42.98246.266-31.52-23.63p=14.73, ap=-2.56
4
Aronis BB Make-on-demand:BLOCK91603
7851668263
 (2S)-2-[(3-cyanophenyl)methylcarbamoylamino]propanoic		-42.95246.246-42.75-16.99p=18.04, ap=-1.26
4
UORSY BB Make-on-demand:BBV-33927970
UORSY BB Make-on-demand:BBV-34168266
Enamine BB Make on Demand:BBV-33927970
Enamine BB Make on Demand:BBV-34168266
7957537791
 (3S)-3-amino-4-tetralin-6-yloxy-butanoic		-42.94248.302-35.03-12.10p=6.39, ap=-2.21
5
NA
8082377247
 (2S)-2-amino-3-(5-methyl-7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-42.92208.221-31.76-16.02p=7.20, ap=-2.34
3
NA
8182931740
 (2S)-2-amino-3-(1H-imidazo[4,5-c]pyridin-2-yl)propanoic		-42.91206.205-44.27-15.69p=17.67, ap=-0.63
3
NA
8276170566
 (2R)-3-(1-ethylbenzimidazol-2-yl)-2-(methylamino)propanoic		-42.89247.298-30.47-16.49p=6.40, ap=-2.33
5
NA
8383103337
 (2S)-3-amino-2-(6-methoxy-1H-indol-3-yl)propanoic		-42.86234.255-31.06-18.08p=7.98, ap=-1.71
4
NA
8437434741
 (2R)-2-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]propanoic		-42.85238.267-40.29-16.29p=15.33, ap=-1.61
5
UORSY BB Make-on-demand:BBV-33206757
UORSY BB Make-on-demand:BBV-5750190
Enamine BB Make on Demand:BBV-5750190
Enamine BB Make on Demand:BBV-33206757
8540958500
 (2S)-3-[(S)-(2,4-difluorophenyl)sulfinyl]-2-methyl-propanoic		-42.84247.242-42.18-14.71p=15.28, ap=-1.23
4
UORSY BB Make-on-demand:BBV-32629774
Enamine BB Make on Demand:BBV-32629774
8640909565
 2-methyl-2-[(1-methylpyrrole-2-carbonyl)amino]propanoic		-42.82209.225-40.07-14.40p=13.16, ap=-1.52
3
UORSY BB Make-on-demand:BBV-32615772
Enamine BB Make on Demand:BBV-32615772
8770390880
 2-(benzofuran-3-carbonylamino)-2-methyl-propanoic		-42.80246.242-34.15-19.76p=12.50, ap=-1.39
3
UORSY BB Make-on-demand:BBV-38625545
Enamine BB Make on Demand:BBV-38625545
eMolecules:48748633
Molport:MolPort-020-899-118
8827849401
 (2S)-3-amino-2-(5-methoxy-1H-indol-3-yl)propanoic		-42.79234.255-35.33-17.80p=11.32, ap=-0.98
4
NA
8940911902
 2-methyl-2-(pyrimidin-2-ylcarbamoylamino)propanoic		-42.78223.212-35.36-18.93p=12.67, ap=-1.17
3
UORSY BB Make-on-demand:BBV-32617282
Enamine BB Make on Demand:BBV-32617282
9082667865
 3-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]propanoic		-42.78247.294-35.74-19.40p=15.18, ap=-2.82
4
NA
9137412053
 (3S)-3-[(6-chloropyridine-3-carbonyl)amino]butanoic		-42.77241.654-37.99-16.60p=12.90, ap=-1.08
4
UORSY BB Make-on-demand:BBV-5739582
Enamine BB Make on Demand:BBV-5739582
9243828288
 3-(3-[(ethylamino)carbonyl]aminophenyl)propanoic acid		-42.76235.263-37.61-16.98p=13.56, ap=-1.73
5
Molport:MolPort-009-194-763
Key Organics Building Blocks:SS-3890
KeyOrganics:SS-3890
Matrix Scientific:054735
Molport BB:MolPort-009-194-763
Enamine BB Make on Demand:BBV-45691823
Ark Pharm Building Blocks:AK-67397
Tractus:TRA0125717
9338589734
 (3S)-4-amino-3-(7-methylbenzofuran-2-yl)butanoic		-42.74233.267-29.61-17.70p=7.36, ap=-2.79
4
NA
9483009676
 (2R)-3-amino-2-(5-methylimidazo[1,2-a]pyridin-2-yl)propanoic		-42.74220.252-31.14-19.83p=10.65, ap=-2.42
3
NA
9583363133
 (3R)-3-amino-4-(o-tolylmethylamino)-4-oxo-butanoic		-42.74235.263-32.70-16.97p=8.94, ap=-2.01
5
UORSY BB Make-on-demand:BBV-39452941
Enamine BB Make on Demand:BBV-39452941
9628630326
 3-[[5-(4-pyridyl)-4H-1,2,4-triazol-3-yl]sulfanyl]propanoic		-42.73249.275-37.51-21.58p=18.14, ap=-1.77
5
Rare Chemicals:BGFA1027
9782312155
 3-(5-phenylisoxazol-3-yl)sulfanylpropanoic		-42.72248.283-38.14-21.96p=19.76, ap=-2.37
5
NA
9882606882
 2-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]amino]acetic		-42.72236.227-39.74-17.71p=15.05, ap=-0.32
3
NA
9939245397
 2-[(R)-2-naphthylsulfinyl]acetic		-42.70233.268-43.42-11.62p=14.53, ap=-2.20
3
Enamine BB Make on Demand:BBV-32718465
10082659154
 3-[4-methoxy-3-(1,2,4-triazol-4-yl)phenyl]propanoic		-42.70246.246-37.91-19.17p=16.96, ap=-2.59
5
NA
1012750051
 2-(5-m-anisyltetrazol-2-yl)acetate		-42.69247.234-36.65-20.24p=15.42, ap=-1.22
5
NA
10276164135
 (2S)-2-hydroxy-3-(3-quinolyl)propanoic		-42.68216.216-41.03-17.39p=17.69, ap=-1.95
3
NA
10320245648
 2-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]acetic		-42.64243.244-55.02-6.96p=20.60, ap=-1.25
4
UORSY BB Make-on-demand:BBV-185392
Enamine BB Make on Demand:BBV-185392
10432015167
 3-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propanoic		-42.63225.253-37.12-19.05p=15.13, ap=-1.59
4
NA
10540531676
 (2S)-2-(3-pyridylcarbamoylamino)propanoic		-42.63208.197-38.65-18.06p=15.05, ap=-0.97
3
UORSY BB Make-on-demand:BBV-32531161
Enamine BB Make on Demand:BBV-32531161a
10649363753
(2S)-2-(piperazin-1-ylsulfonylamino)propanoic		-42.63236.273-49.35-2.18p=8.84, ap=0.07
4
UORSY BB Make-on-demand:BBV-32924806
Enamine BB Make on Demand:BBV-32924806
1071063850
-42.59228.249-43.85-9.70p=12.48, ap=-1.52
4
Labotest:LT03506126
UORSY BB Make-on-demand:BBV-010081
ChemBridge:7963284
eMolecules:2010510
TimTec Building Blocks:SBB071775
Molport:MolPort-002-291-741
Princeton BioMolecular Research:OSSL_312666
Scientific Exchange:M-323332
10895078164
 4-(1H-benzo[d]imidazol-2-yl)piperazine-2-carboxylic acid		-42.59246.270-29.85-17.91p=7.88, ap=-2.72
2
Chembo Pharma:KB-143301
10998092713
 2-[(8R)-6,7,8,9-tetrahydro-5H-pyrido[BLAH:BLAH]pyrrolo[BLAH]pyrimidin-8-yl]acetic		-42.59231.235-40.44-15.55p=14.88, ap=-1.48
2
NA
11075976915
 2-[6-fluoro-2-(2-hydroxyethyl)benzimidazol-1-yl]acetic		-42.55237.210-38.32-16.30p=14.03, ap=-1.95
4
NA
11126274025
 N-(4,5-dicyano-1H-imidazol-2-yl)pyridine-2-carboxamide		-42.54237.202-34.36-22.94p=16.10, ap=-1.36
2
NA
11283111343
 (2R)-3-amino-2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)propanoic		-42.54236.227-30.99-20.46p=10.68, ap=-1.76
3
NA
11382929458
 (2R)-3-amino-2-imidazo[1,2-a]pyridin-7-yl-propanoic		-42.53206.225-33.36-17.81p=10.73, ap=-2.10
3
NA
11483365490
 (2R)-2-amino-4-[(2-hydroxyphenyl)methylamino]-4-oxo-butanoic		-42.53238.243-33.38-16.97p=8.47, ap=-0.65
5
NA
11542703836
 (2R)-2-methyl-3-[methyl(quinazolin-4-yl)amino]propanoic		-42.51244.274-39.71-18.39p=18.29, ap=-2.70
4
UORSY BB Make-on-demand:BBV-33244582
Enamine BB Make on Demand:BBV-33244582
11677389864
 2-[4-(1H-benzimidazol-5-yl)imidazol-1-yl]acetic		-42.51242.238-35.66-19.53p=15.47, ap=-2.78
3
NA
11783333651
 (2R)-3-amino-2-(8-fluoro-2-quinolyl)propanoic		-42.51234.230-31.42-18.89p=9.87, ap=-2.08
3
NA
11871778065
 2-[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]-2-methyl-propanoic		-42.50230.635-31.83-17.99p=9.87, ap=-2.55
3
NA
1194532224
 2-(4-hydroxy-3-sulfo-phenyl)aminoacetic		-42.49245.212-49.99-8.60p=14.69, ap=1.42
4
Aldrich CPR:S274097
ALDRICH
TimTec:ST50544443
12011890608
 (2S)-2-(ethylsulfonylamino)-2-phenyl-acetic		-42.49242.276-40.19-13.79p=13.15, ap=-1.67
5
UORSY BB Make-on-demand:BBV-009005
Enamine BB Make on Demand:BBV-009005
12144126127
 2-[5-methyl-2-[(S)-methylsulfinyl]phenyl]acetic		-42.49211.262-41.70-9.92p=10.67, ap=-1.53
3
Aldrich CPR:PH001510
ALDRICH
12232544252
 2-(6-methoxyquinazolin-4-yl)sulfanylacetic		-42.48249.271-39.39-19.77p=18.79, ap=-2.11
4
NA
12375866833
 (2R)-2-[2-(dimethylamino)pyrimidin-5-yl]-2-hydroxy-propanoic		-42.48210.213-34.70-17.70p=11.66, ap=-1.73
3
NA
12449830156
 3-[(S)-cyano-(dimethylsulfamoylamino)methyl]pyridine		-42.46240.288-35.43-14.62p=8.16, ap=-0.57
4
NA
12557535488
 (3S)-3-amino-4-(8-quinolyloxy)butanoic		-42.46245.258-35.19-14.13p=8.20, ap=-1.35
5
NA
12683020262
 (2S)-3-(2,5-dimethyl-7H-imidazo[1,2-a]imidazol-6-yl)-2-methyl-propanoic		-42.45220.252-37.15-16.51p=14.09, ap=-2.88
3
NA
12782548340
 (3S)-3-amino-4-(2,3-dimethylanilino)-4-oxo-butanoic		-42.40235.263-33.17-14.10p=6.65, ap=-1.78
4
UORSY BB Make-on-demand:BBV-39452636
Enamine BB Make on Demand:BBV-39452636
12857534978
 (3S)-3-amino-4-(2-naphthyloxy)butanoic		-42.38244.270-34.60-12.72p=7.02, ap=-2.08
5
NA
12975866843
 (2R)-2-hydroxy-2-[2-(trifluoromethyl)pyrimidin-5-yl]propanoic		-42.38235.141-34.35-16.64p=9.53, ap=-0.93
3
NA
13076163607
 (2R)-2-hydroxy-2-(6-methoxy-1-methyl-benzimidazol-2-yl)acetic		-42.38235.219-36.70-20.73p=15.72, ap=-0.68
3
NA
13119480542
 2-[4-(sulfamoylamino)phenyl]acetic		-42.37229.237-47.83-9.53p=15.79, ap=-0.79
4
Enamine BB Make on Demand:BBV-074695
13265428050
 (4R)-4-(sulfamoylamino)chromane		-42.37227.265-34.11-14.53p=7.08, ap=-0.81
2
Molport:MolPort-019-648-350
eMolecules:35695006
Enamine:Z300364294
Ambinter:Amb19342156
Mcule:MCULE-5300165999
Mcule Make-on-demand:MCULE-5300165999
13321954902
 2-[(5-methyl-1,2-oxazol-4-yl)formamido]propanoic acid		-42.36197.170-38.53-15.41p=11.98, ap=-0.40
3
UORSY BB Make-on-demand:BBV-007132
UORSY BB Make-on-demand:BBV-33206272
Enamine Building Blocks:EN300-50169
Enamine BB Make on Demand:BBV-007132
Enamine BB Make on Demand:BBV-33206272
Mcule:MCULE-9078587523
Molport BB:MolPort-004-292-006
Ambinter:Amb9704696
13495424245
 3-(4,5,6,7-tetrahydro-1H-indazole-3-carbonylamino)propanoic		-42.36236.251-37.96-17.88p=13.94, ap=-0.45
4
Molport:MolPort-027-944-708
Enamine:Z1443845687
eMolecules:48224272
13576137696
 (2R)-2-(aminomethyl)-3-(6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanoic		-42.35235.247-34.84-18.09p=12.33, ap=-1.75
4
NA
13657516039
 (3S)-3-amino-4-(2,3-dimethylphenoxy)butanoic		-42.34222.264-32.04-15.14p=7.16, ap=-2.32
5
NA
13796986940
 3-(N-carbamoyl-4-chloro-anilino)propanoic		-42.34241.654-36.54-16.88p=13.43, ap=-2.36
4
NA
13895078170
 4-(3H-imidazo[4,5-b]pyridin-2-yl)piperazine-2-carboxylic acid		-42.31247.258-33.42-17.48p=10.61, ap=-2.01
2
Chembo Pharma:KB-143304
13939392441
(2S)-2-amino-2-[3-(methanesulfonamido)phenyl]acetic		-42.30243.264-43.38-12.62p=14.72, ap=-1.02
4
NA
1403750865
 2-(5-chloro-2-mesyl-phenyl)acetate		-42.28247.679-43.32-12.41p=13.19, ap=0.26
3
NA
14120227297
 3-[3-(cyclopropanecarbonyl-methyl-amino)phenyl]propanoic		-42.26246.286-37.34-16.50p=13.79, ap=-2.21
5
NA
14277401210
 4-[(1-methylindol-3-yl)amino]-4-oxo-butanoic		-42.26245.258-41.65-15.62p=17.32, ap=-2.31
4
NA
14382697835
 4-[(2-aminopyridine-3-carbonyl)amino]butanoic		-42.26222.224-35.30-18.95p=12.28, ap=-0.30
5
NA
144310296
 [Methyl-(toluene-4-sulfonyl)-amino]-acetic acid		-42.24242.276-50.22-5.75p=14.80, ap=-1.07
4
Asinex:BAS01558212
Aldrich CPR:PH010831
ALDRICH
UORSY BB Make-on-demand:BBV-156851
Innovapharm:STT-00260681
Labotest:LT00014869
eMolecules:979389
Oakwood Chemical:031896
Enamine Building Blocks:EN300-00674
14551638830
 2-(3-cyano-4-fluoro-anilino)-2-methyl-propanoic		-42.24222.219-37.63-15.49p=12.46, ap=-1.58
3
NA
14664824
 N-4-quinazolinylvaline		-42.23244.274-37.10-19.48p=16.53, ap=-2.18
4
Innovapharm BB Make on Demand:BBV-00019045
Otava:7110950096
ChemBridge BuildingBlocks:6684905
Innovapharm Make-on-Demand:VT-00125260
Otava Premium BB:7110950096
UORSY BB Make-on-demand:BBV-33122373
Mcule:MCULE-3514602624
Molport BB:MolPort-000-305-494
1471731777
 Aspartyl-Glycine		-42.23189.147-54.77-4.00p=15.87, ap=0.67
5
UORSY BB Make-on-demand:BBV-39239777
Tractus:TRA0056779
Enamine BB Make on Demand:BBV-39239777
14857534397
 (3S)-3-amino-4-(4-chloro-2-methyl-phenoxy)butanoic		-42.22243.690-30.63-15.68p=6.30, ap=-2.21
5
NA
14962797165
 2-[3-(benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]acetic		-42.22243.198-33.87-20.99p=14.14, ap=-1.50
3
UORSY BB Make-on-demand:BBV-36960238
Enamine BB Make on Demand:BBV-36960238
15083014699
 (3S)-4-amino-3-(1H-imidazo[4,5-c]pyridin-2-yl)butanoic		-42.22219.224-42.99-16.27p=17.79, ap=-0.75
4
NA
15135135552
 4-(o-tolylmethylamino)-4-oxo-butanoic		-42.21220.248-41.26-13.06p=14.37, ap=-2.26
5
UORSY BB Make-on-demand:BBV-25149332
Enamine BB Make on Demand:BBV-25149332
15282613050
 3-methyl-3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)butanoic		-42.21248.258-37.60-18.10p=15.20, ap=-1.71
3
Enamine BB Make on Demand:BBV-42773455
15382553334
 (1S,2R)-2-[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]cyclopropanecarboxylic		-42.20246.242-40.87-17.13p=16.45, ap=-0.65
2
NA
15496211727
 (2R)-2-[(6-ethylquinazolin-4-yl)amino]propanoic		-42.20244.274-39.07-19.83p=18.93, ap=-2.24
4
NA
155873603
 2-[[1-(p-tolyl)tetrazol-5-yl]thio]acetate		-42.19249.275-39.29-20.91p=19.35, ap=-1.35
4
ChemBridge:9061379
Vitas-M:STK245275
eMolecules:2551286
UORSY BB Make-on-demand:BBV-202203
Molport:MolPort-002-311-698
Ambinter:Amb1904206
AKOS:AKOS003379728
Mcule:MCULE-9513563632
15682366686
 (2R)-2-amino-3-(1-methylbenzimidazol-5-yl)propanoic		-42.18219.244-29.22-17.98p=7.41, ap=-2.39
3
NA
15754432807
 (2R)-3-[(4-amino-1,2,5-oxadiazole-3-carbonyl)amino]-2-methyl-propanoic		-42.17213.173-40.36-15.64p=13.50, ap=0.33
4
UORSY BB Make-on-demand:BBV-34579524
Enamine BB Make on Demand:BBV-34579524
15857518378
 (3R)-3-amino-4-(3-chlorophenoxy)butanoic		-42.17228.655-32.05-16.71p=8.45, ap=-1.87
5
NA
15983040428
 (3S)-3-amino-3-(7-fluorobenzofuran-2-yl)propanoic		-42.17223.203-31.41-15.80p=7.16, ap=-2.12
3
NA
16083111342
 (2S)-3-amino-2-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)propanoic		-42.17236.227-29.96-20.50p=9.94, ap=-1.65
3
NA
161147817
 4-{[(3-methyl-2-thienyl)methyl]amino}-4-oxobutanoic acid		-42.16226.277-42.08-15.06p=16.79, ap=-1.82
5
Maybridge:HTS04005
Maybridge Hit Finder:HTS04005
Enamine BB Make on Demand:BBV-42878842
Molport:MolPort-002-900-823
eMolecules:5830599
UORSY BB Make-on-demand:BBV-42878842
16220677187
 3H-imidazo[5,4-c]pyridine-2-sulfonic		-42.16198.183-45.79-13.72p=17.25, ap=0.09
1
Molport:MolPort-007-927-508
16382377249
 (2S)-2-amino-3-(3-methyl-7H-imidazo[1,2-a]imidazol-6-yl)propanoic		-42.16208.221-30.92-16.91p=8.24, ap=-2.57
3
NA
16442548646
 2-[1-[(3R)-1-methylpyrrolidin-3-yl]tetrazol-5-yl]sulfanylacetic		-42.15243.292-41.75-18.23p=18.03, ap=-0.20
4
UORSY BB Make-on-demand:BBV-32903988
Enamine BB Make on Demand:BBV-32903988
16577426529
 2-[1-[(3R)-1-methylpyrrolidin-3-yl]tetrazol-5-yl]sulfanylacetic		-42.14248.258-40.26-16.31p=14.98, ap=-0.55
3
NA
16683100111
 2-[1-(carboxymethyl)indol-3-yl]acetic		-42.14231.207-48.70-15.18p=24.32, ap=-2.57
4
NA
1675853827
 68228-19-3; C19102; Eglinazine		-42.13230.635-33.36-17.54p=10.99, ap=-2.22
5
Chembo Pharma:KB-226459
16882319070
 4-methyl-3-oxo-1,4-benzoxazine-6-sulfonic		-42.13242.232-33.05-14.30p=5.64, ap=-0.42
1
NA
16971867294
 3-(4-Ethoxy-3,5-difluorophenyl)propionic acid		-42.12230.210-34.51-17.71p=12.28, ap=-2.18
5
Alfa-Aesar:H32979
Molport:MolPort-016-638-072
TimTec Building Blocks:SBB097569
TimTec:SBB097569
Fluorochem:343002
SynQuest Building Blocks:76185
17077368311
 (2R)-2-hydroxy-2-(1-isopropylbenzimidazol-5-yl)acetic		-42.12233.247-37.80-18.88p=16.54, ap=-1.98
3
NA
17135254943
 3-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-5-yl)sulfanyl]propanoic		-42.11236.276-39.44-17.19p=17.00, ap=-2.49
4
Enamine BB Make on Demand:BBV-32046967
UORSY BB Make-on-demand:BBV-32046967
17276581595
 2-[allyl(methylsulfonyl)amino]acetic		-42.11192.216-52.96-3.46p=15.07, ap=-0.76
5
Enamine BB Make on Demand:BBV-41871761
UORSY BB Make-on-demand:BBV-41871761
17395723511
 4-cyano-2-hydroxy-benzenesulfonamide		-42.11198.203-42.73-9.68p=10.92, ap=-0.62
1
Synblock:MB34741
17483367753
 (3R)-3-amino-4-[(2-fluorophenyl)methylamino]-4-oxo-butanoic		-42.10240.234-33.35-15.30p=8.37, ap=-1.82
5
UORSY BB Make-on-demand:BBV-39452618
Enamine BB Make on Demand:BBV-39452618
17543214609
 2-[3-(carboxymethyl)-2,4,6-trimethyl-phenyl]acetic		-42.08234.251-50.81-10.59p=21.49, ap=-2.17
4
ChemMol:96701029
17677010036
 (2S)-2-[3-(hydroxymethyl)-5-methyl-indol-1-yl]butanoic		-42.08246.286-36.37-18.30p=15.19, ap=-2.59
4
NA
17783333943
 (2R)-3-amino-2-(2,7-dimethylpyrrolo[2,3-d]pyrimidin-5-yl)propanoic		-42.08234.259-30.46-17.85p=8.20, ap=-1.97
3
NA
17832012672
 3-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)propanoic		-42.07211.226-40.25-17.07p=16.75, ap=-1.50
3
Otava:1371393
Zylexa Pharma BB:ZP-BB-TV002621
Molport BB:MolPort-008-548-160
Molport:MolPort-008-548-160
Otava Premium BB:1371393
Mcule:MCULE-1403498668
17944283955
 (2R)-2-amino-3-(1-methylbenzimidazol-2-yl)propanoic		-42.07219.244-32.43-17.49p=9.43, ap=-1.58
3
NA
18076684340
 (2R,3S)-2-amino-3-(4-fluoro-1H-indol-2-yl)-3-hydroxy-propanoic		-42.07238.218-30.67-16.28p=6.19, ap=-1.30
3
NA
18183256601
 3-(2,3-dihydrobenzofuran-5-ylcarbamoylamino)propanoic		-42.07249.246-37.49-18.07p=14.68, ap=-1.19
4
NA
18276164283
 (2S)-2-hydroxy-3-[2-(trifluoromethyl)pyrimidin-5-yl]propanoic		-42.06235.141-41.01-14.36p=14.72, ap=-1.41
4
NA
18382539364
 (3R)-3-amino-4-oxo-4-(2-pyridylmethylamino)butanoic		-42.06223.232-34.36-15.58p=9.05, ap=-1.18
5
UORSY BB Make-on-demand:BBV-39239585
Enamine BB Make on Demand:BBV-39239585
18427843970
 (2R)-3-amino-2-(5-fluoro-1H-indol-3-yl)propanoic		-42.05222.219-33.88-15.63p=9.44, ap=-1.97
3
NA
18571543497
 3-[4-(4-fluorophenyl)-1H-imidazol-5-yl]propanoic		-42.04234.230-37.70-16.92p=15.39, ap=-2.81
4
NA
18677365782
 (3S)-3-amino-3-(1-methylbenzimidazol-5-yl)butanoic		-42.04233.271-35.13-16.19p=11.22, ap=-1.94
3
NA
18782607430
 2-[(3R)-1-acetyl-5-fluoro-indolin-3-yl]acetic		-42.04236.222-41.14-10.80p=11.99, ap=-2.08
2
NA
18883333654
 (2S)-3-amino-2-(7-fluoro-2-quinolyl)propanoic		-42.04234.230-31.62-17.12p=8.50, ap=-1.80
3
NA
1898816508
 3-(1,3-benzodioxol-5-yloxy)-2-hydroxypropanoic acid		-42.03225.176-38.62-17.38p=14.32, ap=-0.35
4
ChemBridge:9137718
Scientific Exchange:F-249521
Ambinter:Amb2196575
TimTec Building Blocks:SBB072504
eMolecules:8315160
Princeton BioMolecular Research:OSSL_313036
Molport:MolPort-004-955-745
AKOS:AKOS003399108
19082610574
 4-(1-ethylbenzimidazol-5-yl)-4-oxo-butanoic		-42.03245.258-34.11-19.24p=14.15, ap=-2.83
5
NA
1914983078
 N-(3-methylphenyl)-N-(methylsulfonyl)glycine		-42.02242.276-41.21-10.78p=11.13, ap=-1.14
4
ChemBridge BuildingBlocks:6168232
eMolecules:1375896
AKOS:AKOS000297589
Molport:MolPort-001-975-787
Mcule Make-on-demand:MCULE-9826371085
Molport BB:MolPort-001-975-787
Fluorochem:314868
Ambinter:Amb3459644
19276161356
 (2R)-2-amino-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)propanoic		-42.02212.233-33.23-13.66p=5.27, ap=-0.40
3
NA
19383376385
 (3R)-3-amino-4-[(3-cyanophenyl)methylamino]-4-oxo-butanoic		-42.02247.254-41.14-18.53p=19.54, ap=-1.90
5
UORSY BB Make-on-demand:BBV-39452948
Enamine BB Make on Demand:BBV-39452948
19435720897
 4-(3-fluoro-4-methoxy-anilino)-4-oxo-butanoic		-42.01240.210-38.41-16.18p=13.94, ap=-1.36
5
UORSY BB Make-on-demand:BBV-25047450
Enamine BB Make on Demand:BBV-25047450
19539243390
 4-(3-Chloro-4-methylphenyl)-4-oxobutyric acid		-42.01225.651-35.34-18.05p=13.87, ap=-2.48
4
Molport:MolPort-023-218-349
Aldrich CPR:PH010432
ALDRICH
Ark Pharm Building Blocks:AK148447
Oakwood Chemical:207545
Fluorochem:207545
Chembo Pharma:KB-186546
Molport BB:MolPort-023-218-349
19622996820
 1-(3-methylsulfonylphenyl)imidazolidin-2-one		-42.00240.284-28.97-18.18p=4.82, ap=0.34
2
Mcule:MCULE-1305514531
Ambinter:Amb9678086
Mcule Make-on-demand:MCULE-1305514531
19733427207
 2-[4-(2-aminophenyl)phenoxy]acetic		-42.00242.254-33.04-20.97p=13.73, ap=-1.72
4
NA
19840909377
 2-[(3-chlorobenzoyl)amino]-2-methyl-propanoic		-42.00240.666-33.20-18.25p=11.33, ap=-1.88
3
UORSY BB Make-on-demand:BBV-32615574
Enamine BB Make on Demand:BBV-32615574
19983378180
 (3S)-3-amino-3-[5-(2-methyl-3-pyridyl)-1,3,4-oxadiazol-2-yl]propanoic		-42.00248.242-29.80-17.93p=6.38, ap=-0.65
4
NA
2002565670
 2-(Dimethylsulfamoylamino)acetic acid		-41.99181.193-55.46-2.82p=15.64, ap=0.65
4
TimTec:ST50254505
Molport:MolPort-001-965-988
Matrix Scientific:032750
Oakwood Chemical:056767
UORSY BB Make-on-demand:BBV-191885
Tractus:TRA0113787
Asinex Building Blocks:BAS01770681
Princeton BioMolecular BuildingBlocks:PBMR062887