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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
49234170

Nc1c[nH]c(c1)C(=O)Nc1scc(n1)C1CC1		 Formula:C11H12N4OS
Mol: 248.30
Heavy atoms:17
Aromatic heavy atoms: 10
Fraction Csp3: 0.27
Rotatable bonds: 4
H-bond acceptors: 2
H-bond donors: 3
MR: 67.55
TPSA: 112.04
ILOGP:0.91
XLOGP3: 1.14
WLOGP: 1.94
MLOGP: 0.26
Silicos ITLogP: 2.50
Consensus LogP: 1.35
 ESOL
LogS:-2.27
Solubility(mg/ml): 1.340000
Solubility(mol/l):0.005380
Class:Soluble

Ali
LogS:-3.09
Solubility(mg/ml): 0.203000
Solubility(mol/l): 0.000818
Class:Soluble

SilicosIT
LogS:-3.27
Solubility(mg/ml): 0.134000
Solubility(mol/l): 0.000540
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: Yes
CYP1A2 inhibitor: Yes
CYP2C19:  Yes
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -7.01
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 2.60