| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2011 | 21 | No |
Popular Name: (5R)-9-methylsulfanyl-5-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-dione (5R)-9-methylsulfanyl-5-phenyl-2…
| 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) | 1.81 | 7.13 | -9.25 | 1 | 3 | 0 | 46 | 299.395 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 8.47 | -66.6 | 2 | 3 | 1 | 51 | 300.403 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
