(E)-1-[2-(2,2-dichlorocyclopropanecarbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one

Formula:C19H22N2O2Cl2S Mutagenic:high Tumorigenic:low Reproductive Effective:high (E)-1-[2-(2,2-dichlorocyclopropanecarbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-[2-(2,2-dichlorocyclopropanecarbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one
MolecularFormula	C19H22N2O2Cl2S
Smiles	O=C(C(C1)C1(Cl)Cl)N(CC1)CC1(CC1)CCN1C(/C=C/c1cscc1)=O
InChI	InChI=1S/C19H22Cl2N2O2S/c20-19(21)11-15(19)17(25)23-9-6-18(13-23)4-7-22(8-5-18)16(24)2-1-14-3-10-26-12-14/h1-3,10,12,15H,4-9,11,13H2/t15-/m0/s1
InChIK	RICQHGJYOGCTJR-HNNXBMFYSA-N
TotalMolweight	413.368
Molweight	413.368
MonoisotopicMass	412.077902
CLogP	3.7724
CLogS	-3.739
H Acceptors	4
TotalSurfaceArea	285.54
Relative PSA	0.1875
PolarSurfaceArea	68.86
Druglikeness	5.8782
Mutagenic	high
Tumorigenic	low
Reproductive Effective	high
Irritant	high
Nasty Functions
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	1
Aromatic Atoms	5
Sp3Atoms	11
Symmetricatoms	3
Amides	2
StereoCon	racemate

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1 - (E)-1-[2-(2,2-dichlorocyclopropanecarbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one | 2 - (E)-1-[2-(2,2-dichlorocyclopropanecarbonyl)-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one

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