| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 24 | Yes |
Popular Name: 2-[7-(3,6-dimethylpyrazin-2-yl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetic 2-[7-(3,6-dimethylpyrazin-2-yl)-…
| 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) | -0.19 | 5.02 | -37.2 | 2 | 7 | 0 | 100 | 329.356 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 3.02 | -48.19 | 1 | 7 | -1 | 99 | 328.348 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
