N-(3-cyanophenyl)-4-[(E)-3-phenylprop-2-enoyl]-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide

Formula:C24H24N4O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(3-cyanophenyl)-4-[(E)-3-phenylprop-2-enoyl]-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide is a drug-like molecule.

MolName	N-(3-cyanophenyl)-4-[(E)-3-phenylprop-2-enoyl]-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
MolecularFormula	C24H24N4O2S
Smiles	N#Cc1cccc(NC(N(CC2)CCC22SCCN2C(/C=C/c2ccccc2)=O)=O)c1
InChI	InChI=1S/C24H24N4O2S/c25-18-20-7-4-8-21(17-20)26-23(30)27-13-11-24(12-14-27)28(15-16-31-24)22(29)10-9-19-5-2-1-3-6-19/h1-10,17H,11-16H2,(H,26,30)
InChIK	WUNQIVHABYNRAJ-UHFFFAOYSA-N
TotalMolweight	432.547
Molweight	432.547
MonoisotopicMass	432.161996
CLogP	4.4532
CLogS	-5.862
H Acceptors	6
H Donors	1
TotalSurfaceArea	332.25
Relative PSA	0.22781
PolarSurfaceArea	101.74
Druglikeness	-0.20904
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	4
Amides	3
StereoCon

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