4-[[4-[(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methyl]benzoic acid

Formula:C24H16NO5ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[[4-[(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methyl]benzoic acid is a drug-like molecule.

MolName	4-[[4-[(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]methyl]benzoic acid
MolecularFormula	C24H16NO5ClS
Smiles	OC(c1ccc(COc2ccc(/C=C(/C(N3c(cc4)ccc4Cl)=O)\SC3=O)cc2)cc1)=O
InChI	InChI=1S/C24H16ClNO5S/c25-18-7-9-19(10-8-18)26-22(27)21(32-24(26)30)13-15-3-11-20(12-4-15)31-14-16-1-5-17(6-2-16)23(28)29/h1-13H,14H2,(H,28,29)
InChIK	HLXFEHVQCUVISQ-UHFFFAOYSA-N
TotalMolweight	465.912
Molweight	465.912
MonoisotopicMass	465.043771
CLogP	4.6767
CLogS	-6.722
H Acceptors	6
H Donors	1
TotalSurfaceArea	330.56
Relative PSA	0.25188
PolarSurfaceArea	109.21
Druglikeness	2.9932
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.65625
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	6
Amides	1
AcidicOxygens	1
StereoCon

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