Go Back
ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
75912495

N#Cc1cccc(c1)NC(=O)c1n[nH]cn1		 Formula:C10H7N5O
Mol: 213.20
Heavy atoms:16
Aromatic heavy atoms: 11
Fraction Csp3: 0.00
Rotatable bonds: 3
H-bond acceptors: 4
H-bond donors: 2
MR: 55.31
TPSA: 94.46
ILOGP:0.64
XLOGP3: 0.87
WLOGP: 0.74
MLOGP: -0.42
Silicos ITLogP: 1.06
Consensus LogP: 0.58
 ESOL
LogS:-2.02
Solubility(mg/ml): 2.030000
Solubility(mol/l):0.009540
Class:Soluble

Ali
LogS:-2.44
Solubility(mg/ml): 0.778000
Solubility(mol/l): 0.003650
Class:Soluble

SilicosIT
LogS:-3.47
Solubility(mg/ml): 0.071700
Solubility(mol/l): 0.000337
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: Yes
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -6.98
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 1.82