| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 17 | Yes |
Popular Name: 4-ethyl-N-[(3R)-5-methyl-3H-1,2,4-triazol-3-yl]benzamide 4-ethyl-N-[(3R)-5-methyl-3H-1,2,…
| 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) | 1.60 | 7.48 | -14.17 | 2 | 5 | 0 | 71 | 230.271 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 6.02 | -47.02 | 1 | 5 | -1 | 77 | 229.263 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.60 | 7.51 | -8.41 | 2 | 5 | 0 | 71 | 230.271 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
