In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 25 | Yes |
Popular Name: 6-[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]-3-methyl-[1,2,4]triazolo[3,4-f]pyridazine 6-[4-[(3-methoxyphenyl)methyl]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) | 1.89 | 7.92 | -13.8 | 0 | 7 | 0 | 59 | 338.415 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.89 | 10.15 | -59.4 | 1 | 7 | 1 | 60 | 339.423 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.