In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 23 | Yes |
Popular Name: 6-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]-[1,2,4]triazolo[3,4-f]pyridazine 6-[4-[2-(4-pyridyl)ethyl]piperaz…
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) | 0.89 | 10.11 | -64.69 | 1 | 7 | 1 | 64 | 310.385 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 7.89 | -15.36 | 0 | 7 | 0 | 62 | 309.377 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.