| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2009 | 16 | No |
Popular Name: 1-ethyl-5-(5-mercapto-4-methyl-4H-1,2,4-triazol-3-yl)pyridin-2(1H)-one 1-ethyl-5-(5-mercapto-4-methyl-4…
| 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) | 1.33 | 6.43 | -43.94 | 0 | 5 | -1 | 53 | 235.292 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.60 | 6.59 | -18.98 | 1 | 5 | 0 | 56 | 236.3 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.