| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2008 | 29 | Yes |
Popular Name: 1-[2-[(4-benzylpiperazin-1-yl)methyl]oxazole-4-carbonyl]-1,4-diazepan-5-one 1-[2-[(4-benzylpiperazin-1-yl)me…
| 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) | 0.48 | 4.08 | -52.56 | 2 | 8 | 1 | 83 | 398.487 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.48 | 4.02 | -49.09 | 2 | 8 | 1 | 83 | 398.487 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.48 | 1.7 | -12.56 | 1 | 8 | 0 | 82 | 397.479 | 5 | ↓ |
