[(Z)-2-(1-benzoylbenzimidazol-2-yl)-3-oxo-1,3-diphenylprop-1-enyl] benzoate

Formula:C36H24N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(Z)-2-(1-benzoylbenzimidazol-2-yl)-3-oxo-1,3-diphenylprop-1-enyl] benzoate is not a drug-like molecule.

MolName	[(Z)-2-(1-benzoylbenzimidazol-2-yl)-3-oxo-1,3-diphenylprop-1-enyl] benzoate
MolecularFormula	C36H24N2O4
Smiles	O=C(/C(/c1nc(cccc2)c2n1C(c1ccccc1)=O)=C(/c1ccccc1)\OC(c1ccccc1)=O)c1ccccc1
InChI	InChI=1S/C36H24N2O4/c39-32(25-15-5-1-6-16-25)31(33(26-17-7-2-8-18-26)42-36(41)28-21-11-4-12-22-28)34-37-29-23-13-14-24-30(29)38(34)35(40)27-19-9-3-10-20-27/h1-24H
InChIK	TTZFFQLXNVCTBW-UHFFFAOYSA-N
TotalMolweight	548.597
Molweight	548.597
MonoisotopicMass	548.173608
CLogP	7.2397
CLogS	-7.56
H Acceptors	6
TotalSurfaceArea	421.03
Relative PSA	0.15904
PolarSurfaceArea	78.26
Druglikeness	2.5619
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.35714
Fragments	1
Non HAtoms	42
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	9
Rings Closures	6
Small Rings	6
Aromatic Rings	6
Aromatic Atoms	33
Sp3Atoms	1
Symmetricatoms	8
Aromatic Nitrogens	2
StereoCon

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