In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 23 | Yes |
Popular Name: 2-[4-[[[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]methyl]-1-piperidyl]ethanol 2-[4-[[[(1R)-1-[4-(trifluorometh…
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) | 3.12 | 7.47 | -106.74 | 4 | 3 | 2 | 41 | 332.41 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 6.37 | -35.53 | 3 | 3 | 1 | 37 | 331.402 | 7 | ↓ |