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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
37561107

O=C(Nc1ccn(n1)C)Nc1cccc(c1)N		 Formula:C11H13N5O
Mol: 231.25
Heavy atoms:17
Aromatic heavy atoms: 11
Fraction Csp3: 0.09
Rotatable bonds: 4
H-bond acceptors: 2
H-bond donors: 3
MR: 66.61
TPSA: 84.97
ILOGP:1.66
XLOGP3: 0.45
WLOGP: 1.27
MLOGP: 1.03
Silicos ITLogP: -0.48
Consensus LogP: 0.79
 ESOL
LogS:-1.77
Solubility(mg/ml): 3.910000
Solubility(mol/l):0.016900
Class:Very soluble

Ali
LogS:-1.80
Solubility(mg/ml): 3.640000
Solubility(mol/l): 0.015800
Class:Very soluble

SilicosIT
LogS:-3.02
Solubility(mg/ml): 0.223000
Solubility(mol/l): 0.000966
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: No
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -7.39
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 1
Leadlikeness: 1
Synthetic Accessibility: 2.40