| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 22 | No |
Popular Name: (5R)-9-[(S)-methylsulfinyl]-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol (5R)-9-[(S)-methylsulfinyl]-5-ph…
| 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) | 0.93 | 3.33 | -66.42 | 4 | 4 | 1 | 74 | 318.418 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.93 | 4.31 | -97.74 | 3 | 4 | 0 | 77 | 317.41 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
