| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2006 | 29 | No |
Popular Name: 2-(3,4-dimethylphenyl)-4-(2-pyridylmethylaminomethylene)isoquinoline-1,3-dione 2-(3,4-dimethylphenyl)-4-(2-pyri…
| 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) | 3.10 | -1.03 | -11.71 | 0 | 5 | 0 | 62 | 383.451 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | -0.08 | -43.32 | 1 | 5 | 1 | 64 | 384.459 | 4 | ↓ |
