In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 23 | Yes |
Popular Name: 1-[(4-hydroxy-3-methoxy-phenyl)methyl]-6-methoxy-isoquinolin-7-ol 1-[(4-hydroxy-3-methoxy-phenyl)m…
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) | 2.90 | -2.15 | -11.39 | 2 | 5 | 0 | 71 | 311.337 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | -2.09 | -41.4 | 3 | 5 | 1 | 73 | 312.345 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 207 - 210 | MolMall (formerly Molecular Diversity Preservation International) |