| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: (1-amino-3-isoquinolyl)-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]methanone (1-amino-3-isoquinolyl)-[(3R)-3-…
| 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) | 1.70 | 6.94 | -43.82 | 3 | 5 | 1 | 64 | 285.371 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 4.54 | -11.16 | 2 | 5 | 0 | 62 | 284.363 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
