| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 23 | Yes |
Popular Name: 7-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-9-ol 7-[3-chloro-5-(trifluoromethyl)-…
| 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) | 2.98 | 4.27 | -45.3 | 3 | 4 | 1 | 59 | 345.728 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.98 | 3.01 | -6.55 | 2 | 4 | 0 | 54 | 344.72 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
