| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 21 | Yes |
Popular Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-3-fluoro-benzamidine 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) | 1.61 | 5.89 | -40.07 | 4 | 3 | 1 | 55 | 284.358 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 8.28 | -91.77 | 5 | 3 | 2 | 56 | 285.366 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
