N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-3-hydroxynaphthalene-2-carboxamide

Formula:C18H19N3O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-3-hydroxynaphthalene-2-carboxamide is a drug-like molecule.

MolNameN-[(Z)-1-azabicyclo[2.2.2]octan-3-ylideneamino]-3-hydroxynaphthalene-2-carboxamide
MolecularFormulaC18H19N3O2
SmilesOc1cc2ccccc2cc1C(N/N=C1/C(CC2)CCN2C1)=O
InChIInChI=1S/C18H19N3O2/c22-17-10-14-4-2-1-3-13(14)9-15(17)18(23)20-19-16-11-21-7-5-12(16)6-8-21/h1-4,9-10,12,22H,5-8,11H2,(H,20,23)
InChIKYAPBLALJLJMRGS-UHFFFAOYSA-N
TotalMolweight309.368
Molweight309.368
MonoisotopicMass309.147727
CLogP2.8787
CLogS-3.782
H Acceptors5
H Donors2
TotalSurfaceArea230.99
Relative PSA0.22798
PolarSurfaceArea64.93
Druglikeness7.7513
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.56522
Fragments1
Non HAtoms23
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond2
Rings Closures4
Small Rings5
Aromatic Rings2
Aromatic Atoms10
Sp3Atoms8
Symmetricatoms2
Amines1
AlkylAmines1
BasicNitrogens1
StereoCon

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