In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | No |
Popular Name: (2R)-2-bromo-3-methyl-1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butan-1-one (2R)-2-bromo-3-methyl-1-[4-(2,2,…
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) | 2.33 | 5.02 | -6.39 | 0 | 3 | 0 | 24 | 331.176 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 7.09 | -45.97 | 1 | 3 | 1 | 25 | 332.184 | 4 | ↓ |