UCSF

ZINC36967529

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2009 20 Yes

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

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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) 3.60 9.79 -32.28 2 2 1 16 273.444 4 ↓
Lo Low (pH 4.5-6) 3.60 10.33 -100.46 3 2 2 21 274.452 4 ↓

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Rings

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

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