| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 14th, 2008 | 26 | Yes |
Popular Name: 7-[(2-bromophenyl)methyl]-8-butylamino-1,3-dimethyl-purine-2,6-dione 7-[(2-bromophenyl)methyl]-8-buty…
| 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) | 4.03 | 12.12 | -7.47 | 1 | 7 | 0 | 74 | 420.311 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 12.58 | -32.52 | 2 | 7 | 1 | 75 | 421.319 | 6 | ↓ |
