| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2011 | 22 | Yes |
Popular Name: (1R)-1-(azepane-1-carbonyl)-2-ethyl-1,4-dihydroisoquinolin-3-one (1R)-1-(azepane-1-carbonyl)-2-et…
| 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) | 2.38 | 8.83 | -13.26 | 0 | 4 | 0 | 41 | 300.402 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
