In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 20 | Yes |
Popular Name: 1-[2-[3-(4-pyridyl)propoxy]ethyl]triazole-4-carboxylic 1-[2-[3-(4-pyridyl)propoxy]ethyl…
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) | 0.68 | 4.18 | -53.75 | 0 | 7 | -1 | 93 | 275.288 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.68 | 4.61 | -76.84 | 1 | 7 | 0 | 94 | 276.296 | 8 | ↓ |