In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2011 | 18 | No |
Popular Name: 5-[3-(4-ethoxyphenyl)propyl]-1,3,4-oxadiazole-2-thiol 5-[3-(4-ethoxyphenyl)propyl]-1,3…
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) | 2.89 | 3.44 | -42.77 | 0 | 4 | -1 | 48 | 263.342 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 4.16 | -12.31 | 1 | 4 | 0 | 51 | 264.35 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.