In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 19 | Yes |
Popular Name: 3,5-dihydro-2H-1,4-benzoxazepin-4-yl(piperazin-1-yl)methanone 3,5-dihydro-2H-1,4-benzoxazepin-…
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) | 0.80 | 4.2 | -55.38 | 2 | 5 | 1 | 49 | 262.333 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.80 | 2.94 | -9.75 | 1 | 5 | 0 | 45 | 261.325 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.