| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 22 | No |
Popular Name: 4-(4-ethyl-5-sulfanyl-1,2,4-triazol-3-yl)-N-isopropyl-N-methyl-piperidine-1-sulfonamide 4-(4-ethyl-5-sulfanyl-1,2,4-tria…
| 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) | 0.38 | 6.13 | -20.76 | 1 | 7 | 0 | 74 | 347.51 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.11 | 6.09 | -55.49 | 0 | 7 | -1 | 71 | 346.502 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
