In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 18 | Yes |
Popular Name: (2R)-2,3-dimethyl-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]butan-1-amine (2R)-2,3-dimethyl-2-[4-(2,2,2-tr…
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) | 1.52 | 1.53 | -44.29 | 3 | 3 | 1 | 34 | 268.347 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 3.67 | -114.98 | 4 | 3 | 2 | 35 | 269.355 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 3.6 | -94.51 | 4 | 3 | 2 | 35 | 269.355 | 5 | ↓ |