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ZINC ID                   RADAR Physiochemical Propperties Lipophilicity Water solubility Phyarmacokinetics Druglikeness Medicinal Chemistry
96894153

COc1cccc2c1nc(cc2)C[C@@H]1CCC[NH2+]1		 Formula:C15H19N2O
Mol: 243.32
Heavy atoms:18
Aromatic heavy atoms: 10
Fraction Csp3: 0.40
Rotatable bonds: 3
H-bond acceptors: 2
H-bond donors: 1
MR: 77.99
TPSA: 38.73
ILOGP:2.68
XLOGP3: 2.58
WLOGP: 1.13
MLOGP: -1.71
Silicos ITLogP: 3.31
Consensus LogP: 1.60
 ESOL
LogS:-3.19
Solubility(mg/ml): 0.158000
Solubility(mol/l):0.000650
Class:Soluble

Ali
LogS:-3.04
Solubility(mg/ml): 0.221000
Solubility(mol/l): 0.000908
Class:Soluble

SilicosIT
LogS:-5.17
Solubility(mg/ml): 0.001650
Solubility(mol/l): 0.000007
Class:Moderately soluble
GIAbsorption:High
BBB permeant: Yes
Pgp substrate: Yes
CYP1A2 inhibitor: Yes
CYP2C19:  No
CYP2C9:  No
CYP2D6:  No
CYP3A4:  No
Log kp:  -5.95
Lipinski:0
Ghose: 0
Veber: 0
Egan: 0
Muegge: 0
Bioavalability Score0.55
PAINS:0
Brenk: 0
Leadlikeness: 1
Synthetic Accessibility: 2.61