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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
16545033

O=C(n1cncn1)Nc1cccc2c1cccc2		 Formula:C13H10N4O
Mol: 238.24
Heavy atoms:18
Aromatic heavy atoms: 15
Fraction Csp3: 0.00
Rotatable bonds: 3
H-bond acceptors: 3
H-bond donors: 1
MR: 68.21
TPSA: 59.81
ILOGP:1.53
XLOGP3: 2.52
WLOGP: 2.32
MLOGP: 2.34
Silicos ITLogP: 1.04
Consensus LogP: 1.95
 ESOL
LogS:-3.32
Solubility(mg/ml): 0.113000
Solubility(mol/l):0.000475
Class:Soluble

Ali
LogS:-3.42
Solubility(mg/ml): 0.090100
Solubility(mol/l): 0.000378
Class:Soluble

SilicosIT
LogS:-4.24
Solubility(mg/ml): 0.013800
Solubility(mol/l): 0.000058
Class:Moderately soluble
GIAbsorption:High
BBB permeant: Yes
Pgp substrate: No
CYP1A2 inhibitor: Yes
CYP2C19:  Yes
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -5.96
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 2.05