In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2004 | 12 | No |
Popular Name: Beta-D-Fructopyranose Beta-D-Fructopyranose
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17598-82-2 , 7660-25-5 , 87-79-6 , 87-81-0
(2S,3S,4R,5R)-2-(hydroxymethyl)oxane-2,3,4,5-tetrol
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) | -2.78 | -10.53 | -9 | 5 | 6 | 0 | 110 | 180.156 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Molecular_Solubility | 1.121 | Bitter DB |
ALOGPS_SOLUBILITY | 1.19e+03 g/l | DrugBank-experimental |
Mp [°C] | 158 - 160 | Acros Organics |
MP | 165 | TCI |
UniProt Database Links | AMML_ASTMO; DCXR_CAEEL; DCXR_HYPJE; DHSO1_YEAST; DHSO2_YEAST; DHSO_ARATH; DHSO_BACHD; DHSO_BACSU; DHSO_BOMMO; DHSO_BOVIN; DHSO_HUMAN; DHSO_MACFA; DHSO_MOUSE; DHSO_PIG; DHSO_PONAB; DHSO_RAT; DHSO_RHOSH; DHSO_SCHPO; DHSO_SHEEP; GHRB_ECOLI; P2OX_PHACH; P2OX_ | ChEBI |