(4Z)-1-(3-chlorophenyl)-4-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylidene]pyrazolidine-3,5-dione

Formula:C25H17N3O2ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-1-(3-chlorophenyl)-4-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylidene]pyrazolidine-3,5-dione is a drug-like molecule.

MolName	(4Z)-1-(3-chlorophenyl)-4-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methylidene]pyrazolidine-3,5-dione
MolecularFormula	C25H17N3O2ClF
Smiles	O=C(/C(/C1=O)=C/c2cn(Cc(cc3)ccc3F)c3c2cccc3)NN1c1cccc(Cl)c1
InChI	InChI=1S/C25H17ClFN3O2/c26-18-4-3-5-20(13-18)30-25(32)22(24(31)28-30)12-17-15-29(23-7-2-1-6-21(17)23)14-16-8-10-19(27)11-9-16/h1-13,15H,14H2,(H,28,31)/b22-12-
InChIK	UEKZKCGDCOGBDR-UUYOSTAYSA-N
TotalMolweight	445.88
Molweight	445.88
MonoisotopicMass	445.099332
CLogP	3.5801
CLogS	-4.918
H Acceptors	5
H Donors	1
TotalSurfaceArea	320.58
Relative PSA	0.1496
PolarSurfaceArea	54.34
Druglikeness	4.0065
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.53125
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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