In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 25 | Yes |
Popular Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-ethylpiperazin-1-yl)ethanone 1-(6,7-dimethoxy-3,4-dihydro-1H-…
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) | 0.98 | 6.65 | -41.53 | 1 | 6 | 1 | 46 | 348.467 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 4.37 | -12.14 | 0 | 6 | 0 | 45 | 347.459 | 5 | ↓ |