| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 26th, 2011 | 14 | Yes |
Popular Name: 1-methyl-N-(4H-1,2,4-triazol-3-yl)pyrazole-4-carboxamide 1-methyl-N-(4H-1,2,4-triazol-3-y…
None
| 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) | -1.02 | 3.96 | -16.77 | 2 | 7 | 0 | 88 | 192.182 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.95 | 2.32 | -44.18 | 1 | 7 | -1 | 95 | 191.174 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.02 | 3.76 | -47.96 | 1 | 7 | -1 | 87 | 191.174 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
