(5Z)-5-[[1-(4-chlorophenyl)pyrrol-2-yl]methylidene]-3-cyclohexyl-2-cyclohexylimino-1,3-thiazolidin-4-one

Formula:C26H30N3OClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[[1-(4-chlorophenyl)pyrrol-2-yl]methylidene]-3-cyclohexyl-2-cyclohexylimino-1,3-thiazolidin-4-one is not a drug-like molecule.

MolName	(5Z)-5-[[1-(4-chlorophenyl)pyrrol-2-yl]methylidene]-3-cyclohexyl-2-cyclohexylimino-1,3-thiazolidin-4-one
MolecularFormula	C26H30N3OClS
Smiles	O=C(/C(/S1)=C/c2cccn2-c(cc2)ccc2Cl)N(C2CCCCC2)/C1=N/C1CCCCC1
InChI	InChI=1S/C26H30ClN3OS/c27-19-13-15-21(16-14-19)29-17-7-12-23(29)18-24-25(31)30(22-10-5-2-6-11-22)26(32-24)28-20-8-3-1-4-9-20/h7,12-18,20,22H,1-6,8-11H2
InChIK	LLBATFUNKXFNDU-UHFFFAOYSA-N
TotalMolweight	468.063
Molweight	468.063
MonoisotopicMass	467.179809
CLogP	5.825
CLogS	-9.064
H Acceptors	4
TotalSurfaceArea	352.96
Relative PSA	0.14863
PolarSurfaceArea	62.9
Druglikeness	-2.5917
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	13
Symmetricatoms	6
Amides	1
Aromatic Nitrogens	1
StereoCon

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