4,5,5,5-tetrafluoro-1-[8-[(E)-3-thiophen-3-ylprop-2-enoyl]-2,8-diazaspiro[4.5]decan-2-yl]-4-(trifluoromethyl)pentan-1-one

Formula:C21H23N2O2F7S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4,5,5,5-tetrafluoro-1-[8-[(E)-3-thiophen-3-ylprop-2-enoyl]-2,8-diazaspiro[4.5]decan-2-yl]-4-(trifluoromethyl)pentan-1-one is not a drug-like molecule.

MolName	4,5,5,5-tetrafluoro-1-[8-[(E)-3-thiophen-3-ylprop-2-enoyl]-2,8-diazaspiro[4.5]decan-2-yl]-4-(trifluoromethyl)pentan-1-one
MolecularFormula	C21H23N2O2F7S
Smiles	O=C(CCC(C(F)(F)F)(C(F)(F)F)F)N(CC1)CC1(CC1)CCN1C(/C=C/c1cscc1)=O
InChI	InChI=1S/C21H23F7N2O2S/c22-19(20(23,24)25,21(26,27)28)5-3-17(32)30-11-8-18(14-30)6-9-29(10-7-18)16(31)2-1-15-4-12-33-13-15/h1-2,4,12-13H,3,5-11,14H2
InChIK	OAUOESOEQBFEIM-UHFFFAOYSA-N
TotalMolweight	500.478
Molweight	500.478
MonoisotopicMass	500.136844
CLogP	4.9969
CLogS	-4.925
H Acceptors	4
TotalSurfaceArea	334.73
Relative PSA	0.15995
PolarSurfaceArea	68.86
Druglikeness	-16.401
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	13
Symmetricatoms	8
Amides	2
StereoCon

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1 - 4,5,5,5-tetrafluoro-1-[8-[(E)-3-thiophen-3-ylprop-2-enoyl]-2,8-diazaspiro[4.5]decan-2-yl]-4-(trifluoromethyl)pentan-1-one | 2 - 4,5,5,5-tetrafluoro-1-[8-[(E)-3-thiophen-3-ylprop-2-enoyl]-2,8-diazaspiro[4.5]decan-2-yl]-4-(trifluoromethyl)pentan-1-one

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