Go Back
ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
11990302

Fc1ccccc1CSc1ncn[nH]1		 Formula:C9H8FN3S
Mol: 209.24
Heavy atoms:14
Aromatic heavy atoms: 11
Fraction Csp3: 0.11
Rotatable bonds: 3
H-bond acceptors: 3
H-bond donors: 1
MR: 52.55
TPSA: 66.87
ILOGP:1.59
XLOGP3: 2.43
WLOGP: 2.50
MLOGP: 2.08
Silicos ITLogP: 2.86
Consensus LogP: 2.29
 ESOL
LogS:-3.05
Solubility(mg/ml): 0.186000
Solubility(mol/l):0.000888
Class:Soluble

Ali
LogS:-3.48
Solubility(mg/ml): 0.069800
Solubility(mol/l): 0.000333
Class:Soluble

SilicosIT
LogS:-4.18
Solubility(mg/ml): 0.013800
Solubility(mol/l): 0.000066
Class:Moderately soluble
GIAbsorption:High
BBB permeant: Yes
Pgp substrate: No
CYP1A2 inhibitor: Yes
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -5.85
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 2.12