2-[3-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]acetamide

Formula:C20H15N5O Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[3-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]acetamide is a drug-like molecule.

MolName	2-[3-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]acetamide
MolecularFormula	C20H15N5O
Smiles	NC(Cn1c(cccc2)c2c(/C=C(/c2nc(cccc3)c3[nH]2)\C#N)c1)=O
InChI	InChI=1S/C20H15N5O/c21-10-13(20-23-16-6-2-3-7-17(16)24-20)9-14-11-25(12-19(22)26)18-8-4-1-5-15(14)18/h1-9,11H,12H2,(H2,22,26)(H,23,24)
InChIK	UTSQEGNDCHQZAU-UHFFFAOYSA-N
TotalMolweight	341.373
Molweight	341.373
MonoisotopicMass	341.12766
CLogP	1.5758
CLogS	-2.868
H Acceptors	6
H Donors	2
TotalSurfaceArea	266.2
Relative PSA	0.27686
PolarSurfaceArea	100.49
Druglikeness	-0.45251
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	18
Sp3Atoms	1
Amides	1
Aromatic Nitrogens	3
BasicNitrogens	1
StereoCon

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