| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2014 | 24 | Yes |
Popular Name: (1R,2R,3S,5S)-Isopropyl 4-benzoyl-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate (1R,2R,3S,5S)-Isopropyl 4-benzoy…
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CAS Number: 137819-55-7
| 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) | 2.42 | 6.91 | -8.83 | 1 | 5 | 0 | 67 | 331.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 8.04 | -35.88 | 2 | 5 | 1 | 68 | 332.42 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.