In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 19 | Yes |
Popular Name: 4-[4-methyl-3-(trifluoromethyl)anilino]-4-oxo-butanoic 4-[4-methyl-3-(trifluoromethyl)a…
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 | 6.41 | -44.1 | 1 | 4 | -1 | 69 | 274.218 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 4.43 | -8.84 | 2 | 4 | 0 | 66 | 275.226 | 5 | ↓ |