| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2005 | 14 | No |
Popular Name: 1,4-Butanediol Bis(thioglycolate) 1,4-Butanediol Bis(thioglycolate)
Find On: PubMed — Wikipedia — Google
CAS Number: 10193-95-0
| 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) | 1.22 | 1.15 | -10.54 | 0 | 4 | 0 | 52 | 238.33 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 0.2 | -48.42 | 0 | 4 | -1 | 52 | 237.322 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | -0.76 | -94.38 | 0 | 4 | -2 | 52 | 236.314 | 9 | ↓ |
