N-[(Z)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide

Formula:C24H21N3O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxo-1-thiophen-2-ylprop-1-en-2-yl]benzamide
MolecularFormula	C24H21N3O2S
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1cccs1)NCCc1c[nH]c2c1cccc2
InChI	InChI=1S/C24H21N3O2S/c28-23(17-7-2-1-3-8-17)27-22(15-19-9-6-14-30-19)24(29)25-13-12-18-16-26-21-11-5-4-10-20(18)21/h1-11,14-16,26H,12-13H2,(H,25,29)(H,27,28)
InChIK	YMFIPTLTCNOALR-UHFFFAOYSA-N
TotalMolweight	415.516
Molweight	415.516
MonoisotopicMass	415.135447
CLogP	4.4693
CLogS	-5.336
H Acceptors	5
H Donors	3
TotalSurfaceArea	323.54
Relative PSA	0.25762
PolarSurfaceArea	102.23
Druglikeness	5.3174
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Sp3Atoms	2
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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