2-[5-[(Z)-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid

Formula:C23H14N2O6F2S Mutagenic:high Tumorigenic:high Reproductive Effective:high 2-[5-[(Z)-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid is a drug-like molecule.

MolName	2-[5-[(Z)-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid
MolecularFormula	C23H14N2O6F2S
Smiles	OC(c(cccc1)c1-c1ccc(/C=C(/C(N2CC(Nc(ccc(F)c3)c3F)=O)=O)\SC2=O)o1)=O
InChI	InChI=1S/C23H14F2N2O6S/c24-12-5-7-17(16(25)9-12)26-20(28)11-27-21(29)19(34-23(27)32)10-13-6-8-18(33-13)14-3-1-2-4-15(14)22(30)31/h1-10H,11H2,(H,26,28)(H,30,31)
InChIK	OLXZZTUOWZPAPT-UHFFFAOYSA-N
TotalMolweight	484.434
Molweight	484.434
MonoisotopicMass	484.054064
CLogP	3.1603
CLogS	-6.162
H Acceptors	8
H Donors	2
TotalSurfaceArea	336.74
Relative PSA	0.33221
PolarSurfaceArea	142.22
Druglikeness	4.5689
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.55882
Fragments	1
Non HAtoms	34
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Amides	2
AcidicOxygens	1
StereoCon

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1 - 2-[5-[(Z)-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid | 2 - 2-[5-[(Z)-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid

Request More Details | 2-[5-[(Z)-[3-[2-(2,4-difluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid

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