| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | Yes |
Popular Name: 2-[(1R)-1-(5-ethyl-2-thienyl)ethyl]-3,4-dihydro-1H-isoquinolin-5-amine 2-[(1R)-1-(5-ethyl-2-thienyl)eth…
| 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) | 3.82 | 9.7 | -33.72 | 3 | 2 | 1 | 30 | 287.452 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 7.45 | -4.77 | 2 | 2 | 0 | 29 | 286.444 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
