| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 25 | Yes |
Popular Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2-dimethylaminoethyl)benzamide 4-(3,4-dihydro-1H-isoquinolin-2-…
| 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) | 2.36 | 8.67 | -47.22 | 2 | 4 | 1 | 37 | 338.475 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.36 | 6.13 | -12.15 | 1 | 4 | 0 | 36 | 337.467 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
