| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 18 | Yes |
Popular Name: (1R)-N-[(5-bromo-2-fluoro-phenyl)methyl]-1-(2-pyridyl)ethanamine (1R)-N-[(5-bromo-2-fluoro-phenyl…
| 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) | 3.18 | 7.93 | -36.04 | 2 | 2 | 1 | 29 | 310.19 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.18 | 6.61 | -5.57 | 1 | 2 | 0 | 25 | 309.182 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
