4-[5-[(Z)-[1-(3,5-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzenesulfonamide

Formula:C20H13N3O5Cl2S Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(Z)-[1-(3,5-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName	4-[5-[(Z)-[1-(3,5-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzenesulfonamide
MolecularFormula	C20H13N3O5Cl2S
Smiles	NS(c(cc1)ccc1-c1ccc(/C=C(/C(NN2c3cc(Cl)cc(Cl)c3)=O)\C2=O)o1)(=O)=O
InChI	InChI=1S/C20H13Cl2N3O5S/c21-12-7-13(22)9-14(8-12)25-20(27)17(19(26)24-25)10-15-3-6-18(30-15)11-1-4-16(5-2-11)31(23,28)29/h1-10H,(H,24,26)(H2,23,28,29)
InChIK	KXSABOUGLKKBOC-UHFFFAOYSA-N
TotalMolweight	478.311
Molweight	478.311
MonoisotopicMass	476.995296
CLogP	2.2585
CLogS	-5.721
H Acceptors	8
H Donors	2
TotalSurfaceArea	318.88
Relative PSA	0.31062
PolarSurfaceArea	131.09
Druglikeness	2.9741
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	6
Amides	1
StereoCon

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