In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 34 | Yes |
Popular Name: (3-butoxyphenyl)-fluoro-(4-methyl-2-pyridyl)-BLAHdione (3-butoxyphenyl)-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) | 4.67 | 3.25 | -13.14 | 0 | 6 | 0 | 72 | 458.489 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.67 | 3.41 | -32.62 | 1 | 6 | 1 | 73 | 459.497 | 6 | ↓ |