| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 25th, 2009 | 18 | Yes |
Popular Name: (1S)-1-(3-bromophenyl)-2-(2-pyridylmethylamino)ethanol (1S)-1-(3-bromophenyl)-2-(2-pyri…
| 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) | 1.92 | 3.1 | -9.85 | 2 | 3 | 0 | 45 | 307.191 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.92 | 4.99 | -114.26 | 4 | 3 | 2 | 51 | 309.207 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.92 | 3.48 | -33.02 | 3 | 3 | 1 | 46 | 308.199 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.92 | 4.6 | -43.33 | 3 | 3 | 1 | 50 | 308.199 | 5 | ↓ |
