In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 18 | Yes |
Popular Name: 1-[5-(2-Chloro-4-fluoro-benzylsulfanyl)-[1,3,4]oxadiazol-2-yl]-ethylamine 1-[5-(2-Chloro-4-fluoro-benzylsu…
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) | 0.39 | 0.93 | -47.18 | 3 | 4 | 1 | 67 | 288.755 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 0.6 | -7.62 | 2 | 4 | 0 | 65 | 287.747 | 4 | ↓ |