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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
20050650

O=C(N1CCCC1)C[NH2+]CCc1ccccc1
Formula:C14H21N2O
Mol: 233.33
Heavy atoms:17
Aromatic heavy atoms: 6
Fraction Csp3: 0.50
Rotatable bonds: 6
H-bond acceptors: 1
H-bond donors: 1
MR: 74.01
TPSA: 36.92
ILOGP:2.51
XLOGP3: 1.77
WLOGP: 0.03
MLOGP: -1.97
Silicos ITLogP: 2.44
Consensus LogP: 0.96
ESOL
LogS:-2.27
Solubility(mg/ml): 1.260000
Solubility(mol/l):0.005410
Class:Soluble

Ali
LogS:-2.16
Solubility(mg/ml): 1.600000
Solubility(mol/l): 0.006870
Class:Soluble

SilicosIT
LogS:-4.07
Solubility(mg/ml): 0.020100
Solubility(mol/l): 0.000086
Class:Moderately soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: No
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -6.47
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 1.57