In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 2nd, 2011 | 26 | Yes |
Popular Name: 3-(4-pyridyl)-N-[4-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]propanamide 3-(4-pyridyl)-N-[4-(5,6,7,8-tetr…
None
None
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) | 2.47 | 9.63 | -18.23 | 1 | 6 | 0 | 73 | 347.422 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 10.09 | -50.22 | 2 | 6 | 1 | 74 | 348.43 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.