3-[(Z)-(3-hydroxyphenyl)methylideneamino]-1,3-diazaspiro[4.5]decane-2,4-dione

Formula:C15H17N3O3 Mutagenic:high Tumorigenic:high Reproductive Effective:none 3-[(Z)-(3-hydroxyphenyl)methylideneamino]-1,3-diazaspiro[4.5]decane-2,4-dione is a drug-like molecule.

MolName3-[(Z)-(3-hydroxyphenyl)methylideneamino]-1,3-diazaspiro[4.5]decane-2,4-dione
MolecularFormulaC15H17N3O3
SmilesOc1cccc(/C=N\N(C(C2(CCCCC2)N2)=O)C2=O)c1
InChIInChI=1S/C15H17N3O3/c19-12-6-4-5-11(9-12)10-16-18-13(20)15(17-14(18)21)7-2-1-3-8-15/h4-6,9-10,19H,1-3,7-8H2,(H,17,21)
InChIKPDNJINKKLJUVQD-UHFFFAOYSA-N
TotalMolweight287.318
Molweight287.318
MonoisotopicMass287.126992
CLogP1.8051
CLogS-3.44
H Acceptors6
H Donors2
TotalSurfaceArea213.84
Relative PSA0.30724
PolarSurfaceArea82
Druglikeness1.5479
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.57143
Fragments1
Non HAtoms21
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures3
Small Rings3
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms7
Symmetricatoms2
Amides1
StereoCon

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