| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 21st, 2011 | 25 | No |
Popular Name: 2-(4-tert-butyl-1,4-diazepan-1-yl)-N-(4-methoxy-2-methyl-phenyl)-2-oxo-acetamide 2-(4-tert-butyl-1,4-diazepan-1-y…
| 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) | 2.25 | 7.57 | -35.38 | 2 | 6 | 1 | 63 | 348.467 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 5.87 | -6.04 | 1 | 6 | 0 | 62 | 347.459 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
