In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | Yes |
Popular Name: 4-(6-chloro-[1,2,4]triazolo[3,4-f]pyridazin-3-yl)-2-methyl-quinoline 4-(6-chloro-[1,2,4]triazolo[3,4-…
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) | 3.85 | 8.55 | -12.91 | 0 | 5 | 0 | 56 | 295.733 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 8.93 | -31.81 | 1 | 5 | 1 | 57 | 296.741 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.