| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 21 | Yes |
Popular Name: 5-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1,3-dimethyl-pyrazole-4-carboxylic 5-(3,5-dihydro-2H-1,4-benzoxazep…
| 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) | 1.60 | 8.34 | -35.29 | 1 | 6 | 0 | 72 | 287.319 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.60 | 8.23 | -50.43 | 0 | 6 | -1 | 70 | 286.311 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
