| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | No |
Popular Name: (2S)-2-[(4-bromo-3-nitro-phenyl)methylamino]butan-1-ol (2S)-2-[(4-bromo-3-nitro-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) | 2.43 | 4.59 | -51.61 | 3 | 5 | 1 | 83 | 304.164 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 3.56 | -8.86 | 2 | 5 | 0 | 78 | 303.156 | 6 | ↓ |
