UCSF

ZINC63019962

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2011 19 Yes

Popular Name: (1R,5S)-8-[(1R)-2-methyl-1-phenyl-propyl]-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(1R)-2-methyl-1-pheny…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.69 7.2 -40.41 3 2 1 31 259.417 3 ↓
Lo Low (pH 4.5-6) 2.69 8.67 -105.6 4 2 2 32 260.425 3 ↓

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Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.