N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

Formula:C17H16N4O4S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
MolecularFormula	C17H16N4O4S
Smiles	O=C(C(CC1)=NNC1=O)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C17H16N4O4S/c22-14-7-6-12(19-20-14)15(23)18-8-9-21-16(24)13(26-17(21)25)10-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H,18,23)(H,20,22)
InChIK	PGFUIRWXIPZSIN-UHFFFAOYSA-N
TotalMolweight	372.404
Molweight	372.404
MonoisotopicMass	372.089226
CLogP	0.4457
CLogS	-3.473
H Acceptors	8
H Donors	2
TotalSurfaceArea	270.69
Relative PSA	0.39761
PolarSurfaceArea	133.24
Druglikeness	8.1543
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	5
Symmetricatoms	2
Amides	2
StereoCon

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1 - N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide | 2 - N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

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