(E)-N-(1,3-dioxoisoindol-4-yl)-3-thiophen-2-ylprop-2-enamide

Formula:C15H10N2O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(1,3-dioxoisoindol-4-yl)-3-thiophen-2-ylprop-2-enamide is a drug-like molecule.

MolName	(E)-N-(1,3-dioxoisoindol-4-yl)-3-thiophen-2-ylprop-2-enamide
MolecularFormula	C15H10N2O3S
Smiles	O=C(/C=C/c1cccs1)Nc(cccc1C(N2)=O)c1C2=O
InChI	InChI=1S/C15H10N2O3S/c18-12(7-6-9-3-2-8-21-9)16-11-5-1-4-10-13(11)15(20)17-14(10)19/h1-8H,(H,16,18)(H,17,19,20)
InChIK	JJKCMJKCBFELES-UHFFFAOYSA-N
TotalMolweight	298.321
Molweight	298.321
MonoisotopicMass	298.041213
CLogP	2.084
CLogS	-3.879
H Acceptors	5
H Donors	2
TotalSurfaceArea	218.13
Relative PSA	0.37776
PolarSurfaceArea	103.51
Druglikeness	2.2468
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Amides	2
StereoCon

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