In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 15 | No |
Popular Name: 5-ethyl-4-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]-1,2,4-triazole-3-thiol 5-ethyl-4-[2-[(2S)-tetrahydrofur…
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) | 0.75 | 6.78 | -9.98 | 1 | 4 | 0 | 43 | 227.333 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.48 | 6.67 | -45.32 | 0 | 4 | -1 | 40 | 226.325 | 4 | ↓ |