| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2011 | 27 | Yes |
Popular Name: 1-[(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-4-oxo-quinolizine-3-carboxylic 1-[(6-cyano-3,4-dihydro-1H-isoqu…
None
| 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) | 2.13 | 10.58 | -81.91 | 0 | 6 | -1 | 89 | 358.377 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 12.86 | -110.05 | 1 | 6 | 0 | 90 | 359.385 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
