| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 24 | No |
Popular Name: 4-[(3R)-3-methylsulfanylbutyl]-7-(5-methyl-2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol 4-[(3R)-3-methylsulfanylbutyl]-7…
| 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) | 4.03 | 10.06 | -39.34 | 2 | 3 | 1 | 34 | 364.556 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.03 | 7.98 | -7.15 | 1 | 3 | 0 | 33 | 363.548 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
