In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 24 | No |
Popular Name: N'-(4-chloro-3-fluoro-phenyl)-N-[2-[(2S,6S)-2,6-dimethyl-1-piperidyl]ethyl]oxamide N'-(4-chloro-3-fluoro-phenyl)-N-…
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) | 2.59 | 6.25 | -39.5 | 3 | 5 | 1 | 63 | 356.849 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.46 | -49.18 | 2 | 5 | 0 | 69 | 355.841 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.