| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | Yes |
Popular Name: 3-amino-2-[(1R,2R,4S)-2,4-dimethylcyclohexyl]isoquinolin-1-one 3-amino-2-[(1R,2R,4S)-2,4-dimeth…
| 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) | 3.54 | 9.12 | -8.95 | 2 | 3 | 0 | 48 | 270.376 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
