[4-[(2E)-2-(5-chlorothiophen-2-yl)sulfonylimino-3-cyclohexyl-1,3-thiazol-4-yl]phenyl] benzoate

Formula:C26H23N2O4ClS3 Mutagenic:none Tumorigenic:none Reproductive Effective:high [4-[(2E)-2-(5-chlorothiophen-2-yl)sulfonylimino-3-cyclohexyl-1,3-thiazol-4-yl]phenyl] benzoate is not a drug-like molecule.

MolName	[4-[(2E)-2-(5-chlorothiophen-2-yl)sulfonylimino-3-cyclohexyl-1,3-thiazol-4-yl]phenyl] benzoate
MolecularFormula	C26H23N2O4ClS3
Smiles	O=C(c1ccccc1)Oc(cc1)ccc1C(N1C2CCCCC2)=CS/C1=N/S(c(s1)ccc1Cl)(=O)=O
InChI	InChI=1S/C26H23ClN2O4S3/c27-23-15-16-24(35-23)36(31,32)28-26-29(20-9-5-2-6-10-20)22(17-34-26)18-11-13-21(14-12-18)33-25(30)19-7-3-1-4-8-19/h1,3-4,7-8,11-17,20H,2,5-6,9-10H2
InChIK	FMCWNQNIJPTTJO-UHFFFAOYSA-N
TotalMolweight	559.13
Molweight	559.13
MonoisotopicMass	558.050845
CLogP	7.2541
CLogS	-7.265
H Acceptors	6
TotalSurfaceArea	390.24
Relative PSA	0.26786
PolarSurfaceArea	137.96
Druglikeness	-1.1832
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.52778
Fragments	1
Non HAtoms	36
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	9
Symmetricatoms	7
BasicNitrogens	1
StereoCon

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