1-(3-chlorophenyl)-3-[(E)-2-(4-phenylphenyl)ethenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile

Formula:C32H20N3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:low 1-(3-chlorophenyl)-3-[(E)-2-(4-phenylphenyl)ethenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile is not a drug-like molecule.

MolName	1-(3-chlorophenyl)-3-[(E)-2-(4-phenylphenyl)ethenyl]pyrido[1,2-a]benzimidazole-4-carbonitrile
MolecularFormula	C32H20N3Cl
Smiles	N#Cc1c(/C=C/c(cc2)ccc2-c2ccccc2)cc(-c2cccc(Cl)c2)n2c1nc1c2cccc1
InChI	InChI=1S/C32H20ClN3/c33-27-10-6-9-26(19-27)31-20-25(28(21-34)32-35-29-11-4-5-12-30(29)36(31)32)18-15-22-13-16-24(17-14-22)23-7-2-1-3-8-23/h1-20H
InChIK	IXGZCVHRZFVVBY-UHFFFAOYSA-N
TotalMolweight	481.985
Molweight	481.985
MonoisotopicMass	481.134574
CLogP	8.0995
CLogS	-11.802
H Acceptors	3
TotalSurfaceArea	374.78
Relative PSA	0.086664
PolarSurfaceArea	41.09
Druglikeness	-2.8109
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.47222
Fragments	1
Non HAtoms	36
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	6
Small Rings	6
Aromatic Rings	6
Aromatic Atoms	31
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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