| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 32 | No |
Popular Name: 4-(3-diethylaminopropylaminomethylene)-2-(2,5-dimethoxyphenyl)-isoquinoline-1,3-dione 4-(3-diethylaminopropylaminometh…
| 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) | 3.14 | 0.58 | -47.09 | 1 | 7 | 1 | 72 | 438.548 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 1.53 | -115.28 | 2 | 7 | 2 | 74 | 439.556 | 10 | ↓ |
