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

Formula:C18H22N6O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[2-[2-(tetrazol-1-yl)acetyl]-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-(tetrazol-1-yl)acetyl]-2,8-diazaspiro[4.5]decan-8-yl]-3-thiophen-3-ylprop-2-en-1-one
MolecularFormula	C18H22N6O2S
Smiles	O=C(Cn1nnnc1)N(CC1)CC1(CC1)CCN1C(/C=C/c1cscc1)=O
InChI	InChI=1S/C18H22N6O2S/c25-16(2-1-15-3-10-27-12-15)22-7-4-18(5-8-22)6-9-23(13-18)17(26)11-24-14-19-20-21-24/h1-3,10,12,14H,4-9,11,13H2
InChIK	CFVCHFQRHVTNEW-UHFFFAOYSA-N
TotalMolweight	386.479
Molweight	386.479
MonoisotopicMass	386.152494
CLogP	1.3357
CLogS	-2.311
H Acceptors	8
TotalSurfaceArea	290.53
Relative PSA	0.32121
PolarSurfaceArea	112.46
Druglikeness	4.4347
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.62963
Fragments	1
Non HAtoms	27
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	9
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	4
StereoCon

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

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