In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 21 | Yes |
Popular Name: (2R)-2-[(2R)-2-ethyl-1-piperidyl]-2-[4-(trifluoromethyl)phenyl]ethanamine (2R)-2-[(2R)-2-ethyl-1-piperidyl…
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) | 3.40 | 7.54 | -135.97 | 4 | 2 | 2 | 32 | 302.384 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.40 | 7.24 | -33.97 | 3 | 2 | 1 | 30 | 301.376 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.40 | 5.56 | -50.3 | 3 | 2 | 1 | 31 | 301.376 | 5 | ↓ |