| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 17 | No |
Popular Name: 5-(3-Amino-4,4-Dihyroxy-Butylsulfanylmethyl)-Tetrahydro-Furan-2,3,4-Triol 5-(3-Amino-4,4-Dihyroxy-Butylsul…
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) | -3.40 | -5.44 | -45.94 | 6 | 7 | 0 | 138 | 267.303 | 6 | ↓ |
| Hi High (pH 8-9.5) | -3.40 | -5.76 | -49.97 | 5 | 7 | -1 | 136 | 266.295 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 4.10e+01 g/l | DrugBank-experimental |
