| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 19 | Yes |
Popular Name: 3-(isoquinolin-1-yl)benzoic acid 3-(isoquinolin-1-yl)benzoic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 1206969-87-0
| 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) | 3.61 | 8.88 | -57.53 | 0 | 3 | -1 | 53 | 248.261 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.61 | 9.29 | -53.44 | 1 | 3 | 0 | 54 | 249.269 | 2 | ↓ |
