3-(2-oxo-2-piperidin-1-ylethyl)-1-phenyl-8-[(E)-3-phenylprop-2-enoyl]-1,3,8-triazaspiro[4.5]decan-4-one

Formula:C29H34N4O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-(2-oxo-2-piperidin-1-ylethyl)-1-phenyl-8-[(E)-3-phenylprop-2-enoyl]-1,3,8-triazaspiro[4.5]decan-4-one is a drug-like molecule.

MolName	3-(2-oxo-2-piperidin-1-ylethyl)-1-phenyl-8-[(E)-3-phenylprop-2-enoyl]-1,3,8-triazaspiro[4.5]decan-4-one
MolecularFormula	C29H34N4O3
Smiles	O=C(CN(CN(C1(CC2)CCN2C(/C=C/c2ccccc2)=O)c2ccccc2)C1=O)N1CCCCC1
InChI	InChI=1S/C29H34N4O3/c34-26(15-14-24-10-4-1-5-11-24)31-20-16-29(17-21-31)28(36)32(22-27(35)30-18-8-3-9-19-30)23-33(29)25-12-6-2-7-13-25/h1-2,4-7,10-15H,3,8-9,16-23H2
InChIK	PTDCETDZUMSCQP-UHFFFAOYSA-N
TotalMolweight	486.614
Molweight	486.614
MonoisotopicMass	486.263091
CLogP	3.6182
CLogS	-3.911
H Acceptors	7
TotalSurfaceArea	375.24
Relative PSA	0.1421
PolarSurfaceArea	64.17
Druglikeness	4.5631
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52778
Fragments	1
Non HAtoms	36
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	12
Symmetricatoms	8
Amides	3
StereoCon

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1 - 3-(2-oxo-2-piperidin-1-ylethyl)-1-phenyl-8-[(E)-3-phenylprop-2-enoyl]-1,3,8-triazaspiro[4.5]decan-4-one | 2 - 3-(2-oxo-2-piperidin-1-ylethyl)-1-phenyl-8-[(E)-3-phenylprop-2-enoyl]-1,3,8-triazaspiro[4.5]decan-4-one

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