In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2006 | 19 | No |
Popular Name: 3-(4-methoxyphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thiol 3-(4-methoxyphenyl)-5,5-dioxo-3a…
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) | 1.38 | 3.02 | -23.04 | 1 | 5 | 0 | 59 | 298.389 | 2 | ↓ |
Ref Reference (pH 7) | 1.43 | 2.9 | -21.58 | 1 | 5 | 0 | 61 | 298.389 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 2.2 | -45.89 | 0 | 5 | -1 | 59 | 297.381 | 2 | ↓ |