3-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide

Formula:C27H24N3O5F3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide is not a drug-like molecule.

MolName	3-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
MolecularFormula	C27H24N3O5F3S
Smiles	O=C(/C=C/c(cc1)ccc1S(N1CCOCC1)(=O)=O)Nc1cc(C(Nc2cc(C(F)(F)F)ccc2)=O)ccc1
InChI	InChI=1S/C27H24F3N3O5S/c28-27(29,30)21-4-2-6-23(18-21)32-26(35)20-3-1-5-22(17-20)31-25(34)12-9-19-7-10-24(11-8-19)39(36,37)33-13-15-38-16-14-33/h1-12,17-18H,13-16H2,(H,31,34)(H,32,35)
InChIK	GVHAOZJPWYRYSR-UHFFFAOYSA-N
TotalMolweight	559.564
Molweight	559.564
MonoisotopicMass	559.138876
CLogP	4.1749
CLogS	-4.994
H Acceptors	8
H Donors	2
TotalSurfaceArea	397.58
Relative PSA	0.22921
PolarSurfaceArea	113.19
Druglikeness	-5.9411
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58974
Fragments	1
Non HAtoms	39
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	7
Symmetricatoms	7
Amides	3
StereoCon

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1 - 3-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide | 2 - 3-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide

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