In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: (1S)-1-(2-pyridyl)-N-[2-([1,2,4]triazolo[4,5-a]pyridin-3-yl)ethyl]ethanamine (1S)-1-(2-pyridyl)-N-[2-([1,2,4]…
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) | 1.62 | 7.06 | -14.18 | 1 | 5 | 0 | 55 | 267.336 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.62 | 7.71 | -42.85 | 2 | 5 | 1 | 56 | 268.344 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.