In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 19 | No |
Popular Name: (2R)-2-bromo-3-methyl-1-[4-(2-pyridyl)piperazin-1-yl]butan-1-one (2R)-2-bromo-3-methyl-1-[4-(2-py…
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) | 2.20 | 6.9 | -36.36 | 1 | 4 | 1 | 38 | 327.246 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.20 | 6.62 | -9.55 | 0 | 4 | 0 | 36 | 326.238 | 3 | ↓ |