BDBM36259 (ferrocenemethyl)trimethylamine, 3+::alkyldimethyl(ferrocenylmethy1)ammonium (1+)

SMILES C[N+](C)(C)Cc1ccc[cH-]1

InChI Key InChIKey=ZSRFXSFAYWARIR-UHFFFAOYSA-N

Data  7 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 7 hits for monomerid = 36259   

HostPNGBDBM4((1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23...)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -3.20kcal/mole −TΔS°: 0.598kcal/mole ΔH°: -3.80kcal/mole logk: 210
pH: 5.5 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -4.71kcal/mole −TΔS°: 2.10kcal/mole ΔH°: -6.81kcal/mole logk: 2.90E+3
pH: 5.5 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -4.39kcal/mole −TΔS°: 1.70kcal/mole ΔH°: -6.09kcal/mole logk: 1.58E+3
T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -4.30kcal/mole −TΔS°: 1.50kcal/mole ΔH°: -5.80kcal/mole logk: 1.38E+3
T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -4.11kcal/mole −TΔS°: 0.996kcal/mole ΔH°: -5.11kcal/mole logk: 1.01E+3
T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -3.89kcal/mole −TΔS°: 0.996kcal/mole ΔH°: -4.90kcal/mole logk: 715
T: 24.85°C 
In DepthDetails
HostPNGBDBM36281(BDBM197279 | cucurbit[7]uril)
University Of Miami

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC Data−TΔS°: 4.06kcal/mole ΔH°: -21.3kcal/mole logk: 4.00E+12
T: 25.00°C