2-[(E)-2-phenylethenyl]-3H-benzimidazol-5-amine

Formula:C15H13N3 Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-[(E)-2-phenylethenyl]-3H-benzimidazol-5-amine is a drug-like molecule.

MolName	2-[(E)-2-phenylethenyl]-3H-benzimidazol-5-amine
MolecularFormula	C15H13N3
Smiles	Nc(cc1)cc2c1nc(/C=C/c1ccccc1)[nH]2
InChI	InChI=1S/C15H13N3/c16-12-7-8-13-14(10-12)18-15(17-13)9-6-11-4-2-1-3-5-11/h1-10H,16H2,(H,17,18)
InChIK	PHERGUDHJNSTOR-UHFFFAOYSA-N
TotalMolweight	235.289
Molweight	235.289
MonoisotopicMass	235.110947
CLogP	2.6784
CLogS	-3.323
H Acceptors	3
H Donors	2
TotalSurfaceArea	190.97
Relative PSA	0.21066
PolarSurfaceArea	54.7
Druglikeness	0.012656
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	18
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Symmetricatoms	2
Amines	1
Aromatic Amines	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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