2-[3-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]-N-(4-fluorophenyl)acetamide

Formula:C26H18N5OF Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[3-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]-N-(4-fluorophenyl)acetamide is a drug-like molecule.

MolName	2-[3-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]indol-1-yl]-N-(4-fluorophenyl)acetamide
MolecularFormula	C26H18N5OF
Smiles	N#C/C(/c1nc(cccc2)c2[nH]1)=C\c1cn(CC(Nc(cc2)ccc2F)=O)c2c1cccc2
InChI	InChI=1S/C26H18FN5O/c27-19-9-11-20(12-10-19)29-25(33)16-32-15-18(21-5-1-4-8-24(21)32)13-17(14-28)26-30-22-6-2-3-7-23(22)31-26/h1-13,15H,16H2,(H,29,33)(H,30,31)
InChIK	CXIRVXBBEYMRHN-UHFFFAOYSA-N
TotalMolweight	435.461
Molweight	435.461
MonoisotopicMass	435.149538
CLogP	3.7368
CLogS	-4.605
H Acceptors	6
H Donors	2
TotalSurfaceArea	335.25
Relative PSA	0.20847
PolarSurfaceArea	86.5
Druglikeness	-1.9995
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	24
Sp3Atoms	1
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	3
BasicNitrogens	1
StereoCon

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