N,N'-bis[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanediamide

Formula:C28H34N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanediamide is not a drug-like molecule.

MolNameN,N'-bis[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanediamide
MolecularFormulaC28H34N4O2
SmilesO=C(CCCCCCC(N/N=C(/CCC1)\c2c1cccc2)=O)N/N=C(/CCC1)\c2c1cccc2
InChIInChI=1S/C28H34N4O2/c33-27(31-29-25-17-9-13-21-11-5-7-15-23(21)25)19-3-1-2-4-20-28(34)32-30-26-18-10-14-22-12-6-8-16-24(22)26/h5-8,11-12,15-16H,1-4,9-10,13-14,17-20H2,(H,31,33)(H,32,34)
InChIKPBRWONXOPPXGDO-UHFFFAOYSA-N
TotalMolweight458.604
Molweight458.604
MonoisotopicMass458.268176
CLogP6.6102
CLogS-7.636
H Acceptors6
H Donors2
TotalSurfaceArea375.5
Relative PSA0.1918
PolarSurfaceArea82.92
Druglikeness-4.9735
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.64706
Fragments1
Non HAtoms34
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond9
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms12
Symmetricatoms17
StereoCon

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