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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
18128341

Clc1ccc(cc1)C(=O)Nc1n[nH]cn1
Formula:C9H7ClN4O
Mol: 222.63
Heavy atoms:15
Aromatic heavy atoms: 11
Fraction Csp3: 0.00
Rotatable bonds: 3
H-bond acceptors: 3
H-bond donors: 2
MR: 55.61
TPSA: 70.67
ILOGP:0.74
XLOGP3: 1.78
WLOGP: 1.52
MLOGP: 1.15
Silicos ITLogP: 1.73
Consensus LogP: 1.38
ESOL
LogS:-2.69
Solubility(mg/ml): 0.458000
Solubility(mol/l):0.002060
Class:Soluble

Ali
LogS:-2.88
Solubility(mg/ml): 0.292000
Solubility(mol/l): 0.001310
Class:Soluble

SilicosIT
LogS:-4.00
Solubility(mg/ml): 0.022100
Solubility(mol/l): 0.000099
Class:Moderately soluble
GIAbsorption:High
BBB permeant: Yes
Pgp substrate: No
CYP1A2 inhibitor: Yes
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -6.39
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 1.66