| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 20 | Yes |
Popular Name: (1S)-1-(4-bromo-2-fluoro-phenyl)-N,N-dibutyl-ethane-1,2-diamine (1S)-1-(4-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) | 4.51 | 9.4 | -127.44 | 4 | 2 | 2 | 32 | 347.316 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.51 | 9.06 | -36.84 | 3 | 2 | 1 | 30 | 346.308 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.51 | 7 | -44.9 | 3 | 2 | 1 | 31 | 346.308 | 9 | ↓ |
