In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 18 | Yes |
Popular Name: 2-[2-(isopentylamino)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one 2-[2-(isopentylamino)ethyl]-[1,2…
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) | 1.56 | 7.54 | -43.47 | 2 | 5 | 1 | 56 | 249.338 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.