(5Z)-5-[(2E)-2-[3-(2-hydroxyethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula:C20H16N2O2S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(2E)-2-[3-(2-hydroxyethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-5-[(2E)-2-[3-(2-hydroxyethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
MolecularFormula	C20H16N2O2S3
Smiles	OCCN1c(cccc2)c2S/C1=C/C=C(/C(N1c2ccccc2)=O)\SC1=S
InChI	InChI=1S/C20H16N2O2S3/c23-13-12-21-15-8-4-5-9-16(15)26-18(21)11-10-17-19(24)22(20(25)27-17)14-6-2-1-3-7-14/h1-11,23H,12-13H2
InChIK	IQODAPBHUAGEHT-UHFFFAOYSA-N
TotalMolweight	412.557
Molweight	412.557
MonoisotopicMass	412.037388
CLogP	2.5401
CLogS	-5.992
H Acceptors	4
H Donors	1
TotalSurfaceArea	295.35
Relative PSA	0.32578
PolarSurfaceArea	126.47
Druglikeness	4.197
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51852
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
Amides	1
StereoCon

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1 - (5Z)-5-[(2E)-2-[3-(2-hydroxyethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one | 2 - (5Z)-5-[(2E)-2-[3-(2-hydroxyethyl)-1,3-benzothiazol-2-ylidene]ethylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one

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