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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
38038868

O=C(Cn1cnc(n1)N)NCc1cccc(c1)C		 Formula:C12H15N5O
Mol: 245.28
Heavy atoms:18
Aromatic heavy atoms: 11
Fraction Csp3: 0.25
Rotatable bonds: 5
H-bond acceptors: 3
H-bond donors: 2
MR: 67.76
TPSA: 85.83
ILOGP:1.23
XLOGP3: 0.96
WLOGP: 0.34
MLOGP: 0.78
Silicos ITLogP: 0.48
Consensus LogP: 0.76
 ESOL
LogS:-2.09
Solubility(mg/ml): 2.000000
Solubility(mol/l):0.008170
Class:Soluble

Ali
LogS:-2.35
Solubility(mg/ml): 1.100000
Solubility(mol/l): 0.004470
Class:Soluble

SilicosIT
LogS:-3.40
Solubility(mg/ml): 0.097900
Solubility(mol/l): 0.000399
Class:Soluble
GIAbsorption:High
BBB permeant: No
Pgp substrate: No
CYP1A2 inhibitor: No
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -7.11
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 2.12