| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 20 | Yes |
Popular Name: 4-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-2,5-dimethyl-pyrazol-3-amine 4-(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) | 1.22 | 4.12 | -30.95 | 3 | 5 | 1 | 58 | 273.36 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 3.99 | -9.1 | 2 | 5 | 0 | 56 | 272.352 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 6.2 | -97.31 | 4 | 5 | 2 | 59 | 274.368 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
