In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2008 | 17 | No |
Popular Name: 1-phenyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-2-thiol 5,5-dioxide 1-phenyl-3a,4,6,6a-tetrahydro-1H…
None
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) | 1.37 | 3.61 | -20.28 | 1 | 4 | 0 | 51 | 268.363 | 1 | ↓ |
Ref Reference (pH 7) | 1.33 | 3.74 | -22.27 | 1 | 4 | 0 | 49 | 268.363 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 2.8 | -54.89 | 0 | 4 | -1 | 50 | 267.355 | 1 | ↓ |