(E)-N-[5-[(2,5-dioxopyrrolidin-1-yl)methyl]-1,3,4-oxadiazol-2-yl]-3-phenylprop-2-enamide

Formula:C16H14N4O4 Mutagenic:none Tumorigenic:high Reproductive Effective:none (E)-N-[5-[(2,5-dioxopyrrolidin-1-yl)methyl]-1,3,4-oxadiazol-2-yl]-3-phenylprop-2-enamide is a drug-like molecule.

MolName	(E)-N-[5-[(2,5-dioxopyrrolidin-1-yl)methyl]-1,3,4-oxadiazol-2-yl]-3-phenylprop-2-enamide
MolecularFormula	C16H14N4O4
Smiles	O=C(/C=C/c1ccccc1)Nc1nnc(CN(C(CC2)=O)C2=O)o1
InChI	InChI=1S/C16H14N4O4/c21-12(7-6-11-4-2-1-3-5-11)17-16-19-18-13(24-16)10-20-14(22)8-9-15(20)23/h1-7H,8-10H2,(H,17,19,21)
InChIK	KOTKWFXXZUHHFG-UHFFFAOYSA-N
TotalMolweight	326.311
Molweight	326.311
MonoisotopicMass	326.101506
CLogP	0.8589
CLogS	-2.801
H Acceptors	8
H Donors	1
TotalSurfaceArea	249.52
Relative PSA	0.36141
PolarSurfaceArea	105.4
Druglikeness	-2.0362
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	5
Amides	2
Aromatic Nitrogens	2
StereoCon

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