In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 13 | Yes |
Popular Name: 7-Methoxy-2,3-dihydroisoquinolin-4(1H)-one hydrochloride 7-Methoxy-2,3-dihydroisoquinolin…
Find On: PubMed — Wikipedia — Google
CAS Number: 5119-79-9
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) | 0.87 | 1.66 | -7.68 | 1 | 3 | 0 | 38 | 177.203 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.87 | 3.02 | -50.76 | 2 | 3 | 1 | 43 | 178.211 | 1 | ↓ |