| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 18 | Yes |
Popular Name: (3S)-1-[(6-methoxy-2-pyridyl)methyl]-3-methyl-1,4-diazepan-2-one (3S)-1-[(6-methoxy-2-pyridyl)met…
| 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) | 0.54 | 2.61 | -46.14 | 2 | 5 | 1 | 59 | 250.322 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.54 | 1.39 | -12.61 | 1 | 5 | 0 | 54 | 249.314 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
