| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 17 | Yes |
Popular Name: N-methyl-N-[(1R)-1-(4-pyridyl)ethyl]-1H-triazole-4-carboxamide N-methyl-N-[(1R)-1-(4-pyridyl)et…
| 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) | 0.13 | 2.5 | -9.27 | 1 | 6 | 0 | 75 | 231.259 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 2.48 | -37.16 | 0 | 6 | -1 | 73 | 230.251 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.13 | 2.96 | -38.71 | 2 | 6 | 1 | 76 | 232.267 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
