| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 21 | Yes |
Popular Name: (2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-ethyl-2-phenyl-ethanamine (2S)-2-(3,4-dihydro-1H-isoquinol…
| 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) | 3.13 | 8.91 | -40.51 | 2 | 2 | 1 | 20 | 281.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 11.09 | -120.45 | 3 | 2 | 2 | 21 | 282.431 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
