In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 21 | Yes |
Popular Name: (1R,2R)-1-(4-chlorophenyl)-1-[(3S)-3-ethoxy-1-piperidyl]butan-2-amine (1R,2R)-1-(4-chlorophenyl)-1-[(3…
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) | 3.09 | 5.72 | -48.35 | 3 | 3 | 1 | 40 | 311.877 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.09 | 7.76 | -34.12 | 3 | 3 | 1 | 40 | 311.877 | 6 | ↓ |