In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 24 | Yes |
Popular Name: 2-[(1-ethyl-4-fluoro-benzimidazol-2-yl)methyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile 2-[(1-ethyl-4-fluoro-benzimidazo…
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) | 2.17 | 8.43 | -26.35 | 0 | 6 | 0 | 77 | 325.347 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 8.89 | -36.97 | 1 | 6 | 1 | 78 | 326.355 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.