| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2006 | 31 | No |
Popular Name: 4-(benzylaminomethylene)-2-(3,4-dimethoxyphenyl)-isoquinoline-1,3-dione 4-(benzylaminomethylene)-2-(3,4-…
| 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) | 3.09 | -0.96 | -18.78 | 0 | 6 | 0 | 68 | 414.461 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | -0.06 | -53.73 | 1 | 6 | 1 | 69 | 415.469 | 6 | ↓ |
