(5Z)-3-(6-morpholin-4-yl-6-oxohexyl)-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-4-one

Formula:C18H22N2O3S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-3-(6-morpholin-4-yl-6-oxohexyl)-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-3-(6-morpholin-4-yl-6-oxohexyl)-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-4-one
MolecularFormula	C18H22N2O3S3
Smiles	O=C(CCCCCN(C(/C(/S1)=C/c2cccs2)=O)C1=S)N1CCOCC1
InChI	InChI=1S/C18H22N2O3S3/c21-16(19-8-10-23-11-9-19)6-2-1-3-7-20-17(22)15(26-18(20)24)13-14-5-4-12-25-14/h4-5,12-13H,1-3,6-11H2
InChIK	DRLNFFKVXNSCFI-UHFFFAOYSA-N
TotalMolweight	410.582
Molweight	410.582
MonoisotopicMass	410.079253
CLogP	2.4005
CLogS	-3.7
H Acceptors	5
TotalSurfaceArea	307.05
Relative PSA	0.35509
PolarSurfaceArea	135.48
Druglikeness	-3.6611
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	12
Symmetricatoms	2
Amides	2
StereoCon

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