(5Z)-5-(furan-2-ylmethylidene)-3-(hydroxymethyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C9H7NO3S2 Mutagenic:high Tumorigenic:high Reproductive Effective:high (5Z)-5-(furan-2-ylmethylidene)-3-(hydroxymethyl)-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-5-(furan-2-ylmethylidene)-3-(hydroxymethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C9H7NO3S2
Smiles	OCN(C(/C(/S1)=C/c2ccco2)=O)C1=S
InChI	InChI=1S/C9H7NO3S2/c11-5-10-8(12)7(15-9(10)14)4-6-2-1-3-13-6/h1-4,11H,5H2
InChIK	QHKIZKPSRMCYKI-UHFFFAOYSA-N
TotalMolweight	241.291
Molweight	241.291
MonoisotopicMass	240.986734
CLogP	0.0848
CLogS	-3.142
H Acceptors	4
H Donors	1
TotalSurfaceArea	172.52
Relative PSA	0.51756
PolarSurfaceArea	111.07
Druglikeness	2.6263
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	formaldehyde aduct
Shape Index	0.6
Fragments	1
Non HAtoms	15
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	4
Amides	1
StereoCon

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