Go Back
ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
40483424

CC(N(C(=O)C1([NH3+])CCCC1)CC(=O)[O-])C
Formula:C11H20N2O3
Mol: 228.29
Heavy atoms:16
Aromatic heavy atoms: 0
Fraction Csp3: 0.82
Rotatable bonds: 5
H-bond acceptors: 3
H-bond donors: 1
MR: 59.81
TPSA: 88.08
ILOGP:1.30
XLOGP3: -2.01
WLOGP: -1.47
MLOGP: -3.47
Silicos ITLogP: 0.27
Consensus LogP: -1.08
ESOL
LogS:0.34
Solubility(mg/ml): 9.999999
Solubility(mol/l):2.190000
Class:Highly soluble

Ali
LogS:0.68
Solubility(mg/ml): 9.999999
Solubility(mol/l): 4.840000
Class:Highly soluble

SilicosIT
LogS:-0.79
Solubility(mg/ml): 9.999999
Solubility(mol/l): 0.161000
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: No
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -9.12
Lipinski:0
Ghose: 1
Veber: 0
Egan: 0
Muegge: 1
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 1.87