In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 26 | No |
Popular Name: N'-(3,5-difluorophenyl)-N-[2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-methyl-propyl]oxamide N'-(3,5-difluorophenyl)-N-[2-[(3…
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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) | 2.94 | 7.49 | -35.7 | 3 | 5 | 1 | 63 | 368.448 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.13 | 6.66 | -48.32 | 2 | 5 | 0 | 69 | 367.44 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.