In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2011 | 24 | Yes |
Popular Name: 3-fluoro-5-[2-(2-pyridyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]benzonitrile 3-fluoro-5-[2-(2-pyridyl)-3,4,6,…
None
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 | 8.02 | -11.52 | 1 | 5 | 0 | 69 | 319.343 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.76 | 8.43 | -36.26 | 2 | 5 | 1 | 70 | 320.351 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.