In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 19 | Yes |
Popular Name: 1-[(1-ethylimidazol-2-yl)methyl]-5-isopropyl-triazole-4-carboxylic 1-[(1-ethylimidazol-2-yl)methyl]…
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) | 1.07 | 6.5 | -65.02 | 1 | 7 | 0 | 90 | 263.301 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 6.03 | -52.55 | 0 | 7 | -1 | 89 | 262.293 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.