(5E)-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-(9H-xanthen-9-yl)-1,3-thiazolidin-4-one

Formula:C21H13NO2S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-(9H-xanthen-9-yl)-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5E)-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-(9H-xanthen-9-yl)-1,3-thiazolidin-4-one
MolecularFormula	C21H13NO2S3
Smiles	O=C(/C(/S1)=C\c2cccs2)N(C2c(cccc3)c3Oc3c2cccc3)C1=S
InChI	InChI=1S/C21H13NO2S3/c23-20-18(12-13-6-5-11-26-13)27-21(25)22(20)19-14-7-1-3-9-16(14)24-17-10-4-2-8-15(17)19/h1-12,19H
InChIK	ZTTLKTRQVAGUBZ-UHFFFAOYSA-N
TotalMolweight	407.537
Molweight	407.537
MonoisotopicMass	407.010839
CLogP	4.7623
CLogS	-6.942
H Acceptors	3
TotalSurfaceArea	287.18
Relative PSA	0.32189
PolarSurfaceArea	115.17
Druglikeness	3.5146
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.44444
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	6
Amides	1
StereoCon

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