UCSF

ZINC49257401

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 18 Yes

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

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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) 2.21 5.76 -43.65 3 2 1 31 245.39 2 ↓
Hi High (pH 8-9.5) 2.21 7.13 -30.79 3 2 1 30 245.39 2 ↓

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

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