| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 20 | Yes |
Popular Name: 2-ethoxy-5-[(4-methylsulfonyl-1,4-diazepan-1-yl)methyl]-1,3,4-thiadiazole 2-ethoxy-5-[(4-methylsulfonyl-1,…
| 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) | 0.16 | -1.19 | -16.05 | 0 | 7 | 0 | 76 | 320.44 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.16 | 0.78 | -57.62 | 1 | 7 | 1 | 77 | 321.448 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
