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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
57515727

COc1ccccc1[C@H]([NH+](C)C)CC(=O)[O-]		 Formula:C12H17NO3
Mol: 223.27
Heavy atoms:16
Aromatic heavy atoms: 6
Fraction Csp3: 0.42
Rotatable bonds: 5
H-bond acceptors: 3
H-bond donors: 1
MR: 61.11
TPSA: 53.80
ILOGP:2.26
XLOGP3: -1.02
WLOGP: -1.30
MLOGP: -2.29
Silicos ITLogP: 1.28
Consensus LogP: -0.21
 ESOL
LogS:-0.53
Solubility(mg/ml): 9.999999
Solubility(mol/l):0.296000
Class:Very soluble

Ali
LogS:0.38
Solubility(mg/ml): 9.999999
Solubility(mol/l): 2.380000
Class:Highly soluble

SilicosIT
LogS:-2.47
Solubility(mg/ml): 0.757000
Solubility(mol/l): 0.003390
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: No
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -8.39
Lipinski:0
Ghose: 1
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 2.11