| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 20 | Yes |
Popular Name: 1-[3-methoxypropyl(methyl)amino]isoquinoline-3-carboxylic 1-[3-methoxypropyl(methyl)amino]…
| 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) | 2.56 | 8.47 | -34.45 | 1 | 5 | 0 | 67 | 274.32 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 8.08 | -63.86 | 0 | 5 | -1 | 65 | 273.312 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
