| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 15 | Yes |
Popular Name: (1S,2S)-N-[(5-bromo-2-pyridyl)methyl]-2-methyl-cyclopentanamine (1S,2S)-N-[(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) | 2.95 | 6.54 | -38.93 | 2 | 2 | 1 | 29 | 270.194 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 5.32 | -2.22 | 1 | 2 | 0 | 25 | 269.186 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
