In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 18 | Yes |
Popular Name: 4-oxo-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butanoic 4-oxo-4-[4-(2,2,2-trifluoroethyl…
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) | 0.27 | 3.98 | -46.16 | 0 | 5 | -1 | 64 | 267.227 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.27 | 6.05 | -71.47 | 1 | 5 | 0 | 65 | 268.235 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.27 | 2 | -10.2 | 1 | 5 | 0 | 61 | 268.235 | 5 | ↓ |