BDBM36115 1-methyl-3-phenylpropylamine

SMILES CC([NH3+])CCc1ccccc1

InChI Key InChIKey=WECUIGDEWBNQJJ-UHFFFAOYSA-O

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 = 36115   

HostPNGBDBM11(beta-cyclodextrin | betadex)
Japan Science And Technology Agency

GuestPNGBDBM36115(1-methyl-3-phenylpropylamine)
ITC DataΔG°: -3.10kcal/mole −TΔS°: -1.04kcal/mole ΔH°: -2.06kcal/mole logk: 188
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Japan Science And Technology Agency

GuestPNGBDBM36115(1-methyl-3-phenylpropylamine)
ITC DataΔG°: -3.10kcal/mole −TΔS°: -1.04kcal/mole ΔH°: -2.06kcal/mole logk: 188
pH: 6.9 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Japan Science And Technology Agency

GuestPNGBDBM36115(1-methyl-3-phenylpropylamine)
ITC DataΔG°: -3.18kcal/mole −TΔS°: -0.904kcal/mole ΔH°: -2.27kcal/mole logk: 215
pH: 6.9 T: 25.00°C 
HostPNGBDBM36127(6-Amino-6-deoxy-beta-cyclodextrin (am-beta-CD) | 6...)
Japan Science And Technology Agency

GuestPNGBDBM36115(1-methyl-3-phenylpropylamine)
ITC DataΔG°: -2.68kcal/mole −TΔS°: -0.862kcal/mole ΔH°: -1.81kcal/mole logk: 92
pH: 6.9 T: 25.00°C