(4Z)-4-[[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione

Formula:C24H18N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione is a drug-like molecule.

MolName	(4Z)-4-[[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]methylidene]-1-phenylpyrazolidine-3,5-dione
MolecularFormula	C24H18N2O5
Smiles	O=C(/C(/C1=O)=C/c2cc(OCc(cc3)cc4c3OCO4)ccc2)NN1c1ccccc1
InChI	InChI=1S/C24H18N2O5/c27-23-20(24(28)26(25-23)18-6-2-1-3-7-18)12-16-5-4-8-19(11-16)29-14-17-9-10-21-22(13-17)31-15-30-21/h1-13H,14-15H2,(H,25,27)
InChIK	DSXBSQIJQYDBFR-UHFFFAOYSA-N
TotalMolweight	414.416
Molweight	414.416
MonoisotopicMass	414.121573
CLogP	2.8031
CLogS	-4.942
H Acceptors	7
H Donors	1
TotalSurfaceArea	305.27
Relative PSA	0.23288
PolarSurfaceArea	77.1
Druglikeness	3.7696
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	2
StereoCon

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