(4Z)-1-(4-chlorophenyl)-4-(furan-2-ylmethylidene)pyrazolidine-3,5-dione

Formula:C14H9N2O3Cl Mutagenic:high Tumorigenic:none Reproductive Effective:none (4Z)-1-(4-chlorophenyl)-4-(furan-2-ylmethylidene)pyrazolidine-3,5-dione is a drug-like molecule.

MolName	(4Z)-1-(4-chlorophenyl)-4-(furan-2-ylmethylidene)pyrazolidine-3,5-dione
MolecularFormula	C14H9N2O3Cl
Smiles	O=C(/C(/C1=O)=C/c2ccco2)NN1c(cc1)ccc1Cl
InChI	InChI=1S/C14H9ClN2O3/c15-9-3-5-10(6-4-9)17-14(19)12(13(18)16-17)8-11-2-1-7-20-11/h1-8H,(H,16,18)
InChIK	ZXAUFGWONRMXLC-UHFFFAOYSA-N
TotalMolweight	288.689
Molweight	288.689
MonoisotopicMass	288.03017
CLogP	1.1383
CLogS	-3.308
H Acceptors	5
H Donors	1
TotalSurfaceArea	206.6
Relative PSA	0.26718
PolarSurfaceArea	62.55
Druglikeness	3.7483
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Symmetricatoms	2
StereoCon

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