In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | Yes |
Popular Name: (2R)-2-[(3R)-3-ethyl-1-piperidyl]-2-(3-methoxyphenyl)ethanamine (2R)-2-[(3R)-3-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) | 2.41 | 6.76 | -118.31 | 4 | 3 | 2 | 41 | 264.413 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 7.02 | -29.88 | 3 | 3 | 1 | 40 | 263.405 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 4.87 | -42.17 | 3 | 3 | 1 | 40 | 263.405 | 5 | ↓ |