In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2011 | 29 | Yes |
Popular Name: 6-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]-2-phenyl-pyrazolo[3,4-d]pyridazin-7-one 6-[[methyl-[2-(3-methylphenoxy)e…
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) | 3.20 | 11.39 | -46.36 | 1 | 7 | 1 | 66 | 390.467 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 8.86 | -23.43 | 0 | 7 | 0 | 65 | 389.459 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.