(E)-1-[4-(3-fluorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]-3-phenylprop-2-en-1-one

Formula:C23H23N2O2FS Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[4-(3-fluorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]-3-phenylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-[4-(3-fluorobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-8-yl]-3-phenylprop-2-en-1-one
MolecularFormula	C23H23N2O2FS
Smiles	O=C(/C=C/c1ccccc1)N(CC1)CCC11SCCN1C(c1cc(F)ccc1)=O
InChI	InChI=1S/C23H23FN2O2S/c24-20-8-4-7-19(17-20)22(28)26-15-16-29-23(26)11-13-25(14-12-23)21(27)10-9-18-5-2-1-3-6-18/h1-10,17H,11-16H2
InChIK	PMSNRZRPOMBUMU-UHFFFAOYSA-N
TotalMolweight	410.512
Molweight	410.512
MonoisotopicMass	410.146426
CLogP	4.7245
CLogS	-4.887
H Acceptors	4
TotalSurfaceArea	305.43
Relative PSA	0.1659
PolarSurfaceArea	65.92
Druglikeness	2.2889
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	4
Amides	2
StereoCon

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