| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 19 | Yes |
Popular Name: 2-bromo-6-methoxy-4-[[(4-methyl-1,2,4-triazol-3-yl)methylamino]methyl]phenol 2-bromo-6-methoxy-4-[[(4-methyl-…
| 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) | 0.83 | 5.11 | -62.36 | 3 | 6 | 1 | 77 | 328.19 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 4.67 | -54.93 | 1 | 6 | -1 | 75 | 326.174 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 3.75 | -17 | 2 | 6 | 0 | 72 | 327.182 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 6.02 | -75.43 | 2 | 6 | 0 | 80 | 327.182 | 5 | ↓ |
