(E)-2-cyano-3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide

Formula:C22H18N4O Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-cyano-3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide is a drug-like molecule.

MolName	(E)-2-cyano-3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
MolecularFormula	C22H18N4O
Smiles	N#C/C(/C(NCCc1c[nH]c2c1cccc2)=O)=C\c1c[nH]c2c1cccc2
InChI	InChI=1S/C22H18N4O/c23-12-16(11-17-14-26-21-8-4-2-6-19(17)21)22(27)24-10-9-15-13-25-20-7-3-1-5-18(15)20/h1-8,11,13-14,25-26H,9-10H2,(H,24,27)
InChIK	GTAUCQQATUYSFF-UHFFFAOYSA-N
TotalMolweight	354.412
Molweight	354.412
MonoisotopicMass	354.148061
CLogP	3.2066
CLogS	-4.748
H Acceptors	5
H Donors	3
TotalSurfaceArea	284.51
Relative PSA	0.23212
PolarSurfaceArea	84.47
Druglikeness	-0.98817
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.59259
Fragments	1
Non HAtoms	27
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	18
Sp3Atoms	2
Amides	1
Aromatic Nitrogens	2
StereoCon

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