(Z)-2-(1,3-benzothiazol-2-yl)-3-thiophen-3-ylprop-2-enenitrile

Formula:C14H8N2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-2-(1,3-benzothiazol-2-yl)-3-thiophen-3-ylprop-2-enenitrile is a drug-like molecule.

MolName	(Z)-2-(1,3-benzothiazol-2-yl)-3-thiophen-3-ylprop-2-enenitrile
MolecularFormula	C14H8N2S2
Smiles	N#C/C(/c1nc(cccc2)c2s1)=C/c1cscc1
InChI	InChI=1S/C14H8N2S2/c15-8-11(7-10-5-6-17-9-10)14-16-12-3-1-2-4-13(12)18-14/h1-7,9H
InChIK	NZARDQCPMSKKGR-UHFFFAOYSA-N
TotalMolweight	268.364
Molweight	268.364
MonoisotopicMass	268.012888
CLogP	3.1242
CLogS	-3.793
H Acceptors	2
TotalSurfaceArea	204.68
Relative PSA	0.31879
PolarSurfaceArea	93.16
Druglikeness	-3.0693
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55556
Fragments	1
Non HAtoms	18
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	14
Aromatic Nitrogens	1
StereoCon

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