In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 23 | Yes |
Popular Name: 6-[4-[(1R)-1-(3-pyridyl)ethyl]piperazin-1-yl]-[1,2,4]triazolo[3,4-f]pyridazine 6-[4-[(1R)-1-(3-pyridyl)ethyl]pi…
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) | 1.09 | 7.89 | -14.57 | 0 | 7 | 0 | 62 | 309.377 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 9.81 | -57.4 | 1 | 7 | 1 | 64 | 310.385 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.