| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 18 | No |
Popular Name: 4-(4-pyrrolidin-1-ylphenyl)-3-sulfanyl-1H-1,2,4-triazol-5-one 4-(4-pyrrolidin-1-ylphenyl)-3-su…
| 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) | 0.87 | 6.42 | -11.9 | 2 | 5 | 0 | 57 | 262.338 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.60 | 6.4 | -39.69 | 1 | 5 | -1 | 54 | 261.33 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
