In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 18 | Yes |
Popular Name: 2-[[5-(ethylamino)-1,3-dimethyl-pyrazol-4-yl]methyl]pyridazin-3-one 2-[[5-(ethylamino)-1,3-dimethyl-…
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) | 0.69 | 4.22 | -27.83 | 2 | 6 | 1 | 66 | 248.31 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.69 | 4.1 | -12.81 | 1 | 6 | 0 | 65 | 247.302 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.