In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 21 | Yes |
Popular Name: 2-bromo-6-[[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethylamino]methyl]phenol 2-bromo-6-[[2-([1,2,4]triazolo[4…
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) | 2.73 | 5.84 | -14.47 | 2 | 5 | 0 | 62 | 347.216 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 6.6 | -45.58 | 1 | 5 | -1 | 65 | 346.208 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.