| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 19 | Yes |
Popular Name: [(1R,3R)-1-methyl-1-phenyl-3,4-dihydro-2H-isoquinolin-3-yl]methanol [(1R,3R)-1-methyl-1-phenyl-3,4-d…
| 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) | 3.07 | 5.94 | -32.85 | 3 | 2 | 1 | 37 | 254.353 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 5.01 | -4.85 | 2 | 2 | 0 | 32 | 253.345 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0336228A1; US5059608 | IBM Patent Data |
