In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 14th, 2007 | 32 | Yes |
Popular Name: (3-ethoxyphenyl)-fluoro-(4-methyl-2-pyridyl)-BLAHdione (3-ethoxyphenyl)-fluoro-(4-methy…
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) | 3.61 | 12.07 | -13.12 | 0 | 6 | 0 | 73 | 430.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 12.47 | -34.12 | 1 | 6 | 1 | 74 | 431.443 | 4 | ↓ |