| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 20th, 2011 | 29 | Yes |
Popular Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(4-dimethylaminophenyl)benzamide 4-(3,4-dihydro-1H-isoquinolin-2-…
None
| 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) | 4.12 | 10.54 | -11.9 | 1 | 4 | 0 | 36 | 385.511 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 12.81 | -52.17 | 2 | 4 | 1 | 37 | 386.519 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.12 | 13.57 | -93.64 | 3 | 4 | 0 | 38 | 387.527 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
