In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-1-[(3S)-3-ethoxy-1-piperidyl]-1-(p-tolyl)butan-2-amine (1R,2S)-1-[(3S)-3-ethoxy-1-piper…
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) | 2.87 | 6.07 | -41.4 | 3 | 3 | 1 | 40 | 291.459 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 8.14 | -29.01 | 3 | 3 | 1 | 40 | 291.459 | 6 | ↓ |