| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 16 | Yes |
Popular Name: N1-[(5-bromo-2-pyridyl)methyl]cyclohexane-1,4-diamine N1-[(5-bromo-2-pyridyl)methyl]cy…
| 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) | 1.10 | 3.66 | -104.27 | 5 | 3 | 2 | 57 | 286.217 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 2.47 | -44.94 | 4 | 3 | 1 | 53 | 285.209 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
