| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 20 | Yes |
Popular Name: (2R)-4-(1-isoquinolyl)-1-methyl-piperazine-2-carboxylic (2R)-4-(1-isoquinolyl)-1-methyl-…
| 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) | -0.06 | 9.12 | -34.9 | 1 | 5 | 0 | 61 | 271.32 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.06 | 9.6 | -64.98 | 2 | 5 | 1 | 62 | 272.328 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
