BDBM36277 alpha-cyclodextrin doubly bridged dimer, 6

SMILES OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@H]5CSSC[C@H]6O[C@@H]7O[C@@H]8[C@@H](CO)O[C@H](O[C@@H]9[C@@H](CO)O[C@H](O[C@@H]%10[C@@H](CSSC[C@H]%11O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]%11O[C@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O[C@@H](O5)[C@H](O)[C@H]4O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)O[C@H](O[C@@H]1[C@@H](CO)O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@H]6[C@H](O)[C@H]7O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)[C@H](O)[C@H]%10O)[C@H](O)[C@H]9O)[C@H](O)[C@H]8O)[C@H](O)[C@H]3O

InChI Key InChIKey=DTPVZMSJLDWAMF-PKOTZRQHSA-N

Data  8 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- ITC Data from BindingDB

Found 8 hits for monomerid = 36277   

HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM36278(1,9-nonanediol)
ITC DataΔG°: -6.88kcal/mole −TΔS°: 4.63kcal/mole ΔH°: -11.5kcal/mole logk: 1.11E+5
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM36279(1,10-decanediol)
ITC DataΔG°: -8.66kcal/mole −TΔS°: 5.68kcal/mole ΔH°: -14.3kcal/mole logk: 2.23E+6
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM36274(1,11-undecanediol)
ITC DataΔG°: -10.2kcal/mole −TΔS°: 6.25kcal/mole ΔH°: -16.4kcal/mole logk: 2.96E+7
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM50046090(1,12-dodecanediol | CHEMBL17440 | Dodecane-1,12-di...)
ITC DataΔG°: -11.9kcal/mole −TΔS°: 6.20kcal/mole ΔH°: -18.1kcal/mole logk: 4.86E+8
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM36275(1,13-tridecanediol)
ITC DataΔG°: -12.8kcal/mole −TΔS°: 6.74kcal/mole ΔH°: -19.6kcal/mole logk: 2.54E+9
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM36276(1,14-tetradecanediol)
ITC DataΔG°: -13.5kcal/mole −TΔS°: 6.77kcal/mole ΔH°: -20.3kcal/mole logk: 8.59E+9
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM22607(1-Nonanol | Nonan-1-ol)
ITC DataΔG°: -8.62kcal/mole −TΔS°: 2.70kcal/mole ΔH°: -11.3kcal/mole logk: 2.07E+6
T: 25.00°C 
HostPNGBDBM36277(alpha-cyclodextrin doubly bridged dimer, 6)
Institute Of Organic Chemistry And Biochemistry As Cr

GuestPNGBDBM36280(1-decanol)
ITC DataΔG°: -10.0kcal/mole −TΔS°: 4.42kcal/mole ΔH°: -14.4kcal/mole logk: 2.14E+7
T: 25.00°C