In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 24 | Yes |
Popular Name: 1-[(2S)-3-(4-cyanophenoxy)-2-hydroxy-propyl]-N,N-dimethyl-piperidine-4-carboxamide 1-[(2S)-3-(4-cyanophenoxy)-2-hyd…
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) | 0.82 | 6.03 | -57.58 | 2 | 6 | 1 | 78 | 332.424 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.82 | 3.81 | -16.12 | 1 | 6 | 0 | 77 | 331.416 | 6 | ↓ |