2-[(3Z)-3-(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]-N-(2-phenylethyl)acetamide

Formula:C27H27N3O3S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(3Z)-3-(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]-N-(2-phenylethyl)acetamide is not a drug-like molecule.

MolName	2-[(3Z)-3-(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]-N-(2-phenylethyl)acetamide
MolecularFormula	C27H27N3O3S2
Smiles	O=C(CN(c(cccc1)c1/C1=C(\C(N2C3CCCCC3)=O)/SC2=S)C1=O)NCCc1ccccc1
InChI	InChI=1S/C27H27N3O3S2/c31-22(28-16-15-18-9-3-1-4-10-18)17-29-21-14-8-7-13-20(21)23(25(29)32)24-26(33)30(27(34)35-24)19-11-5-2-6-12-19/h1,3-4,7-10,13-14,19H,2,5-6,11-12,15-17H2,(H,28,31)
InChIK	CDFNITPWLTUYTB-UHFFFAOYSA-N
TotalMolweight	505.661
Molweight	505.661
MonoisotopicMass	505.149382
CLogP	2.6421
CLogS	-5.507
H Acceptors	6
H Donors	1
TotalSurfaceArea	373.53
Relative PSA	0.2762
PolarSurfaceArea	127.11
Druglikeness	0.45059
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54286
Fragments	1
Non HAtoms	35
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	11
Symmetricatoms	4
Amides	3
StereoCon

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1 - 2-[(3Z)-3-(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]-N-(2-phenylethyl)acetamide | 2 - 2-[(3Z)-3-(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]-N-(2-phenylethyl)acetamide

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