In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 20 | Yes |
Popular Name: N,N-diethyl-2-[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-1-piperidyl]acetamide N,N-diethyl-2-[(3S)-3-(3-methyl-…
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) | 0.52 | 5.9 | -43.07 | 1 | 6 | 1 | 64 | 281.38 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 3.72 | -10.22 | 0 | 6 | 0 | 62 | 280.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.