| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2011 | 24 | Yes |
Popular Name: (2S)-4-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetyl]-1-methyl-piperazine-2-carboxylic (2S)-4-[2-(3,5-dihydro-2H-1,4-be…
| 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) | -1.37 | 8.22 | -89.97 | 2 | 7 | 1 | 79 | 334.396 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.37 | 6.19 | -48.3 | 1 | 7 | 0 | 77 | 333.388 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
