(4Z)-4-[[3-chloro-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione

Formula:C22H20N3O5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[[3-chloro-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione is a drug-like molecule.

MolName	(4Z)-4-[[3-chloro-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione
MolecularFormula	C22H20N3O5Cl
Smiles	O=C(COc(ccc(/C=C(/C(NN1c2ccccc2)=O)\C1=O)c1)c1Cl)N1CCOCC1
InChI	InChI=1S/C22H20ClN3O5/c23-18-13-15(6-7-19(18)31-14-20(27)25-8-10-30-11-9-25)12-17-21(28)24-26(22(17)29)16-4-2-1-3-5-16/h1-7,12-13H,8-11,14H2,(H,24,28)
InChIK	RCZOGNJKUDYZQT-UHFFFAOYSA-N
TotalMolweight	441.87
Molweight	441.87
MonoisotopicMass	441.109149
CLogP	1.1988
CLogS	-3.116
H Acceptors	8
H Donors	1
TotalSurfaceArea	320.26
Relative PSA	0.24255
PolarSurfaceArea	88.18
Druglikeness	5.5136
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	7
Symmetricatoms	4
Amides	1
StereoCon

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