| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 28 | No |
Popular Name: 8-(2-bromo-3-phenyl-prop-2-enylidene)aminoamino-7-but-2-enyl-3-methyl-purine-2,6-dione 8-(2-bromo-3-phenyl-prop-2-enyli…
| 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) | 2.78 | 11.28 | -11.67 | 2 | 8 | 0 | 97 | 443.305 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 11.79 | -32.42 | 3 | 8 | 1 | 98 | 444.313 | 6 | ↓ |
