| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 15 | Yes |
Popular Name: 1-[(5-chlorothiadiazol-4-yl)methyl]-1,4-diazepan-5-one 1-[(5-chlorothiadiazol-4-yl)meth…
| 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) | 0.61 | 1.6 | -44.7 | 2 | 5 | 1 | 59 | 247.731 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | -0.38 | -8.78 | 1 | 5 | 0 | 58 | 246.723 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
