BDBM3 thymidine/ATP (1:1 mixture)

SMILES COc1ccc(Nc2oc3cc(=O)ccc3cc2C(=O)NCC2CCCO2)cc1

InChI Key InChIKey=GKETXHKHJGXDQB-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 3   

CellThymidine Kinase(Human herpesvirus 1)
Swiss Federal Institute Of Technology

SyringePNGBDBM3(thymidine/ATP (1:1 mixture))
ITC DataΔG°: -16.9kcal/mole −TΔS°: 16.4kcal/mole ΔH°: -33.2kcal/mole
pH: 7.5 T: 25.00°C 
CellThymidine Kinase(Human herpesvirus 1)
Swiss Federal Institute Of Technology

SyringePNGBDBM3(thymidine/ATP (1:1 mixture))
ITC DataΔG°: -17.3kcal/mole −TΔS°: 13.3kcal/mole ΔH°: -30.6kcal/mole
pH: 7.5 T: 20.00°C 
CellThymidine Kinase(Human herpesvirus 1)
Swiss Federal Institute Of Technology

SyringePNGBDBM3(thymidine/ATP (1:1 mixture))
ITC DataΔG°: -19.0kcal/mole −TΔS°: 8.95kcal/mole ΔH°: -28.0kcal/mole
pH: 7.5 T: 15.00°C 
CellThymidine Kinase(Human herpesvirus 1)
Swiss Federal Institute Of Technology

SyringePNGBDBM3(thymidine/ATP (1:1 mixture))
ITC DataΔG°: -19.0kcal/mole −TΔS°: 6.02kcal/mole ΔH°: -25.5kcal/mole
pH: 7.5 T: 10.00°C