| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 19 | Yes |
Popular Name: (2S)-N1-[(4-bromo-2-fluoro-phenyl)methyl]-N2,N2,4-trimethyl-pentane-1,2-diamine (2S)-N1-[(4-bromo-2-fluoro-pheny…
| 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) | 4.07 | 7.58 | -42.81 | 2 | 2 | 1 | 20 | 332.281 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.07 | 6.39 | -2.6 | 1 | 2 | 0 | 15 | 331.273 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 9.57 | -124.14 | 3 | 2 | 2 | 21 | 333.289 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.07 | 8.17 | -36.75 | 2 | 2 | 1 | 16 | 332.281 | 7 | ↓ |
