In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 18 | Yes |
Popular Name: 2-[(2S)-1-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-2-piperidyl]-N-methyl-ethanamine 2-[(2S)-1-[(5-ethyl-1,3,4-oxadia…
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) | 0.30 | 0.87 | -47.07 | 2 | 5 | 1 | 59 | 253.37 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.30 | 2.57 | -109.57 | 3 | 5 | 2 | 60 | 254.378 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.