| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 16 | Yes |
Popular Name: (1R,3S)-3-[(5-bromo-2-pyridyl)methylamino]cyclohexanol (1R,3S)-3-[(5-bromo-2-pyridyl)me…
| 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) | 1.83 | 3.08 | -41.91 | 3 | 3 | 1 | 50 | 286.193 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.83 | 1.9 | -6.09 | 2 | 3 | 0 | 45 | 285.185 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
