| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 21 | Yes |
Popular Name: 3-amino-2-[(1S)-1-(2-thienyl)butyl]isoquinolin-1-one 3-amino-2-[(1S)-1-(2-thienyl)but…
| 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) | 4.31 | 9.73 | -10.47 | 2 | 3 | 0 | 48 | 298.411 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
