UCSF

ZINC70324511

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2011 20 Yes

Popular Name: (1R,5S)-8-[[1-(1-ethylpropyl)pyrazol-3-yl]methyl]-8-azabicyclo[3.2.1]octan-3-ol (1R,5S)-8-[[1-(1-ethylpropyl)pyr…

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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) 2.31 7.1 -27.55 2 4 1 42 278.42 5 ↓
Hi High (pH 8-9.5) 2.31 4.67 -6.35 1 4 0 41 277.412 5 ↓

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

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