[(E)-2-(1-benzylbenzimidazol-2-yl)-1-phenylethenyl] benzoate

Formula:C29H22N2O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-2-(1-benzylbenzimidazol-2-yl)-1-phenylethenyl] benzoate is not a drug-like molecule.

MolName	[(E)-2-(1-benzylbenzimidazol-2-yl)-1-phenylethenyl] benzoate
MolecularFormula	C29H22N2O2
Smiles	O=C(c1ccccc1)O/C(/c1ccccc1)=C/c1nc(cccc2)c2n1Cc1ccccc1
InChI	InChI=1S/C29H22N2O2/c32-29(24-16-8-3-9-17-24)33-27(23-14-6-2-7-15-23)20-28-30-25-18-10-11-19-26(25)31(28)21-22-12-4-1-5-13-22/h1-20H,21H2
InChIK	DMQWWJXOLRGXSL-UHFFFAOYSA-N
TotalMolweight	430.506
Molweight	430.506
MonoisotopicMass	430.168128
CLogP	6.0693
CLogS	-4.813
H Acceptors	4
TotalSurfaceArea	341.32
Relative PSA	0.11977
PolarSurfaceArea	44.12
Druglikeness	2.0255
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.45455
Fragments	1
Non HAtoms	33
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	7
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	27
Sp3Atoms	2
Symmetricatoms	6
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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