In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2007 | 32 | Yes |
Popular Name: fluoro-(4-isopropylphenyl)-(5-methyl-2-pyridyl)-BLAHdione fluoro-(4-isopropylphenyl)-(5-me…
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) | 4.77 | 3.82 | -12.8 | 0 | 5 | 0 | 63 | 428.463 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.77 | 3.97 | -31.27 | 1 | 5 | 1 | 64 | 429.471 | 3 | ↓ |