(E)-3-(1H-indol-3-yl)-2-thiophen-2-ylprop-2-enenitrile

Formula:C15H10N2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(1H-indol-3-yl)-2-thiophen-2-ylprop-2-enenitrile is a drug-like molecule.

MolName	(E)-3-(1H-indol-3-yl)-2-thiophen-2-ylprop-2-enenitrile
MolecularFormula	C15H10N2S
Smiles	N#C/C(/c1cccs1)=C\c1c[nH]c2c1cccc2
InChI	InChI=1S/C15H10N2S/c16-9-11(15-6-3-7-18-15)8-12-10-17-14-5-2-1-4-13(12)14/h1-8,10,17H
InChIK	KFSIJILQNGDITB-UHFFFAOYSA-N
TotalMolweight	250.324
Molweight	250.324
MonoisotopicMass	250.056468
CLogP	3.2386
CLogS	-4.164
H Acceptors	2
H Donors	1
TotalSurfaceArea	199.55
Relative PSA	0.24009
PolarSurfaceArea	67.82
Druglikeness	-2.0197
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55556
Fragments	1
Non HAtoms	18
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	14
Aromatic Nitrogens	1
StereoCon

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