(E)-3-(3-nitrophenyl)-N-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)prop-2-enamide

Formula:C15H10N4O4S Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-(3-nitrophenyl)-N-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(3-nitrophenyl)-N-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)prop-2-enamide
MolecularFormula	C15H10N4O4S
Smiles	[O-][N+](c1cccc(/C=C/C(Nc2nnc(-c3cccs3)o2)=O)c1)=O
InChI	InChI=1S/C15H10N4O4S/c20-13(7-6-10-3-1-4-11(9-10)19(21)22)16-15-18-17-14(23-15)12-5-2-8-24-12/h1-9H,(H,16,18,20)
InChIK	YVPPAQUZELLEMN-UHFFFAOYSA-N
TotalMolweight	342.334
Molweight	342.334
MonoisotopicMass	342.042276
CLogP	2.4328
CLogS	-5.879
H Acceptors	8
H Donors	1
TotalSurfaceArea	255.31
Relative PSA	0.43606
PolarSurfaceArea	142.08
Druglikeness	-2.3028
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
Amides	1
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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