In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 21 | Yes |
Popular Name: 4-[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]sulfonylphenol 4-[(1S)-1-(3-tert-butyl-1,2,4-ox…
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) | 2.09 | 0.69 | -16 | 1 | 6 | 0 | 93 | 310.375 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.09 | 1.45 | -45.97 | 0 | 6 | -1 | 96 | 309.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.