| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 19 | Yes |
Popular Name: 2-bromo-6-[[2-(4-methylpiperazin-1-yl)ethylamino]methyl]phenol 2-bromo-6-[[2-(4-methylpiperazin…
| 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) | 1.91 | 3.86 | -95.1 | 4 | 4 | 2 | 45 | 330.27 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 2.25 | -32.52 | 2 | 4 | 0 | 46 | 328.254 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 1.5 | -43.36 | 3 | 4 | 1 | 43 | 329.262 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
