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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
76689780

[O-]C(=O)C[C@@H]1[NH2+][C@H](C)Cc2c1[nH]c1c2nccc1		 Formula:C13H15N3O2
Mol: 245.28
Heavy atoms:18
Aromatic heavy atoms: 9
Fraction Csp3: 0.38
Rotatable bonds: 2
H-bond acceptors: 3
H-bond donors: 2
MR: 70.65
TPSA: 85.42
ILOGP:1.33
XLOGP3: -1.81
WLOGP: -1.45
MLOGP: -3.14
Silicos ITLogP: 1.80
Consensus LogP: -0.66
 ESOL
LogS:-0.46
Solubility(mg/ml): 9.999999
Solubility(mol/l):0.348000
Class:Very soluble

Ali
LogS:0.53
Solubility(mg/ml): 9.999999
Solubility(mol/l): 3.410000
Class:Highly soluble

SilicosIT
LogS:-3.50
Solubility(mg/ml): 0.076900
Solubility(mol/l): 0.000313
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: No
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -9.08
Lipinski:0
Ghose: 1
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 3.09