(5Z)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione

Formula:C14H8NO3ClS Mutagenic:high Tumorigenic:high Reproductive Effective:none (5Z)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione is a drug-like molecule.

MolName(5Z)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-1,3-thiazolidine-2,4-dione
MolecularFormulaC14H8NO3ClS
SmilesO=C(/C(/S1)=C/c2ccc(-c(cccc3)c3Cl)o2)NC1=O
InChIInChI=1S/C14H8ClNO3S/c15-10-4-2-1-3-9(10)11-6-5-8(19-11)7-12-13(17)16-14(18)20-12/h1-7H,(H,16,17,18)
InChIKUKOAKDJZVZQHAH-UHFFFAOYSA-N
TotalMolweight305.741
Molweight305.741
MonoisotopicMass304.991341
CLogP3.0343
CLogS-5.345
H Acceptors4
H Donors1
TotalSurfaceArea213.79
Relative PSA0.3234
PolarSurfaceArea84.61
Druglikeness4.0181
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.6
Fragments1
Non HAtoms20
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms1
Amides1
StereoCon

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