2-[(E)-2-(2-chlorophenyl)ethenyl]-5-thiophen-2-yl-1,3,4-oxadiazole

Formula:C14H9N2OClS Mutagenic:none Tumorigenic:high Reproductive Effective:none 2-[(E)-2-(2-chlorophenyl)ethenyl]-5-thiophen-2-yl-1,3,4-oxadiazole is a drug-like molecule.

MolName	2-[(E)-2-(2-chlorophenyl)ethenyl]-5-thiophen-2-yl-1,3,4-oxadiazole
MolecularFormula	C14H9N2OClS
Smiles	Clc1c(/C=C/c2nnc(-c3cccs3)o2)cccc1
InChI	InChI=1S/C14H9ClN2OS/c15-11-5-2-1-4-10(11)7-8-13-16-17-14(18-13)12-6-3-9-19-12/h1-9H
InChIK	GKNDEPSMZWIOAG-UHFFFAOYSA-N
TotalMolweight	288.757
Molweight	288.757
MonoisotopicMass	288.01241
CLogP	4.2107
CLogS	-5.422
H Acceptors	3
TotalSurfaceArea	217.85
Relative PSA	0.25894
PolarSurfaceArea	67.16
Druglikeness	2.6374
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63158
Fragments	1
Non HAtoms	19
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Aromatic Nitrogens	2
StereoCon

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