2-[(E)-2-(4-aminophenyl)ethenyl]-3H-benzimidazol-5-amine

Formula:C15H14N4 Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-[(E)-2-(4-aminophenyl)ethenyl]-3H-benzimidazol-5-amine is a drug-like molecule.

MolName	2-[(E)-2-(4-aminophenyl)ethenyl]-3H-benzimidazol-5-amine
MolecularFormula	C15H14N4
Smiles	Nc1ccc(/C=C/c2nc(ccc(N)c3)c3[nH]2)cc1
InChI	InChI=1S/C15H14N4/c16-11-4-1-10(2-5-11)3-8-15-18-13-7-6-12(17)9-14(13)19-15/h1-9H,16-17H2,(H,18,19)
InChIK	YFVRRUJVGAAROY-UHFFFAOYSA-N
TotalMolweight	250.304
Molweight	250.304
MonoisotopicMass	250.121846
CLogP	2.0011
CLogS	-3.399
H Acceptors	4
H Donors	3
TotalSurfaceArea	199.49
Relative PSA	0.27821
PolarSurfaceArea	80.72
Druglikeness	0.012656
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.68421
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	15
Symmetricatoms	2
Amines	2
Aromatic Amines	2
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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