(Z)-4-[[2-carbamoyl-5-(4-chlorophenyl)thiophen-3-yl]amino]-4-oxobut-2-enoic acid

Formula:C15H11N2O4ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-4-[[2-carbamoyl-5-(4-chlorophenyl)thiophen-3-yl]amino]-4-oxobut-2-enoic acid is a drug-like molecule.

MolName	(Z)-4-[[2-carbamoyl-5-(4-chlorophenyl)thiophen-3-yl]amino]-4-oxobut-2-enoic acid
MolecularFormula	C15H11N2O4ClS
Smiles	NC(c(sc(-c(cc1)ccc1Cl)c1)c1NC(/C=C\C(O)=O)=O)=O
InChI	InChI=1S/C15H11ClN2O4S/c16-9-3-1-8(2-4-9)11-7-10(14(23-11)15(17)22)18-12(19)5-6-13(20)21/h1-7H,(H2,17,22)(H,18,19)(H,20,21)
InChIK	BABSHXLTCZFKHW-UHFFFAOYSA-N
TotalMolweight	350.781
Molweight	350.781
MonoisotopicMass	350.012805
CLogP	2.2018
CLogS	-4.687
H Acceptors	6
H Donors	3
TotalSurfaceArea	250.46
Relative PSA	0.39651
PolarSurfaceArea	137.73
Druglikeness	3.7496
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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