| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 17 | Yes |
Popular Name: N1-[(2-bromo-4-fluoro-phenyl)methyl]-N2,N2,2-trimethyl-propane-1,2-diamine N1-[(2-bromo-4-fluoro-phenyl)met…
| 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) | 3.24 | 8.28 | -113.34 | 3 | 2 | 2 | 21 | 305.235 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.24 | 4.95 | -2.18 | 1 | 2 | 0 | 15 | 303.219 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 6.2 | -37.55 | 2 | 2 | 1 | 20 | 304.227 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.24 | 7.06 | -34.73 | 2 | 2 | 1 | 16 | 304.227 | 5 | ↓ |
