N-[(E)-1-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)ethenyl]benzamide

Formula:C23H17N3O3 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(E)-1-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)ethenyl]benzamide is a drug-like molecule.

MolName	N-[(E)-1-(1H-benzimidazol-2-yl)-2-(1,3-benzodioxol-5-yl)ethenyl]benzamide
MolecularFormula	C23H17N3O3
Smiles	O=C(c1ccccc1)N/C(/c1nc(cccc2)c2[nH]1)=C/c(cc1)cc2c1OCO2
InChI	InChI=1S/C23H17N3O3/c27-23(16-6-2-1-3-7-16)26-19(22-24-17-8-4-5-9-18(17)25-22)12-15-10-11-20-21(13-15)29-14-28-20/h1-13H,14H2,(H,24,25)(H,26,27)
InChIK	HVXKWYMQSIPYSG-UHFFFAOYSA-N
TotalMolweight	383.406
Molweight	383.406
MonoisotopicMass	383.126992
CLogP	4.2162
CLogS	-4.935
H Acceptors	6
H Donors	2
TotalSurfaceArea	289.89
Relative PSA	0.23961
PolarSurfaceArea	76.24
Druglikeness	2.1668
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.44828
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	3
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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