In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 20 | Yes |
Popular Name: 1-(4-isopropylphenyl)-6-methyl-4-oxo-pyridazine-3-carboxylic 1-(4-isopropylphenyl)-6-methyl-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) | 2.76 | 9.22 | -65.35 | 0 | 5 | -1 | 75 | 271.296 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 8.4 | -30.84 | 1 | 5 | 0 | 78 | 272.304 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.