Compile Data Set for Download or QSAR
maximum 50k data

Found 332 hits with non-zero ITC data for monomer = 11   

HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36146(2-naphthalenesulfonate | napsylate)
ITC DataΔG°: -30.7kJ/mole −TΔS°: -1.34kJ/mole ΔH°: -29.4kJ/mole logk: 2.34E+5
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36249(1-Adamantanemethanol)
ITC DataΔG°: -29.9kJ/mole −TΔS°: 1.30kJ/mole ΔH°: -31.3kJ/mole logk: 1.42E+5
pH: 7.0 T: 30.10°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM50216627((alpha-methyl-1-adamantyl)methylamine | 1-Adamanta...)
ITC DataΔG°: -26.4kJ/mole −TΔS°: 2.18kJ/mole ΔH°: -28.6kJ/mole logk: 3.52E+4
pH: 7.0 T: 30.10°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36148(1-naphthaleneacetate)
ITC DataΔG°: -24.8kJ/mole −TΔS°: -20.2kJ/mole ΔH°: -4.65kJ/mole logk: 2.24E+4
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36266((-)-borneol)
ITC DataΔG°: -24.5kJ/mole −TΔS°: -1.34kJ/mole ΔH°: -23.2kJ/mole logk: 1.98E+4
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36265((+)-borneol)
ITC DataΔG°: -24.4kJ/mole −TΔS°: -3.52kJ/mole ΔH°: -20.9kJ/mole logk: 1.86E+4
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36258(4-[(4-hydroxyphenyl)azo]benzoate)
ITC DataΔG°: -23.1kJ/mole −TΔS°: -5.90kJ/mole ΔH°: -17.2kJ/mole logk: 1.10E+4
T: 24.85°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36257(3-[(4-hydroxyphenyl)azo]benzoate)
ITC DataΔG°: -22.9kJ/mole −TΔS°: -5.39kJ/mole ΔH°: -17.5kJ/mole logk: 1.00E+4
T: 24.85°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36263((+)-camphor)
ITC DataΔG°: -22.4kJ/mole −TΔS°: -8.53kJ/mole ΔH°: -13.8kJ/mole logk: 8.26E+3
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36077((R)-N,N-dimethyl-1-ferrocenylethylamine | (S)-N,N-...)
ITC DataΔG°: -21.8kJ/mole −TΔS°: 6.89kJ/mole ΔH°: -28.7kJ/mole logk: 6.70E+3
pH: 4.8 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36106((1R,2R,3S,5R)-pinanediol)
ITC DataΔG°: -21.7kJ/mole −TΔS°: -1.31kJ/mole ΔH°: -20.4kJ/mole logk: 6.43E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36107((1S,2S,3R,5S)-pinanediol)
ITC DataΔG°: -21.7kJ/mole −TΔS°: -1.40kJ/mole ΔH°: -20.3kJ/mole logk: 6.36E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36077((R)-N,N-dimethyl-1-ferrocenylethylamine | (S)-N,N-...)
ITC DataΔG°: -21.4kJ/mole −TΔS°: 7.19kJ/mole ΔH°: -28.6kJ/mole logk: 5.60E+3
pH: 4.8 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36253(FC8+Br-)
ITC DataΔG°: -21.2kJ/mole −TΔS°: -0.626kJ/mole ΔH°: -20.6kJ/mole logk: 5.12E+3
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36264((-)-camphor)
ITC DataΔG°: -21.1kJ/mole −TΔS°: 2.74kJ/mole ΔH°: -23.8kJ/mole logk: 4.99E+3
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36168(deoxycholate (DCA))
ITC DataΔG°: -21.0kJ/mole −TΔS°: 4.77kJ/mole ΔH°: -25.8kJ/mole logk: 4.84E+3
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36261(alkyldimethyl(ferrocenylmethy1)ammonium (3+))
ITC DataΔG°: -21kJ/mole −TΔS°: 2.09kJ/mole ΔH°: -23kJ/mole logk: 4.80E+3
pH: 2.6 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36194(cyclooctanol)
ITC DataΔG°: -20.8kJ/mole −TΔS°: -4.41kJ/mole ΔH°: -16.4kJ/mole logk: 4.41E+3
pH: 6.9 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36194(cyclooctanol)
ITC DataΔG°: -20.8kJ/mole −TΔS°: -5.10kJ/mole ΔH°: -15.7kJ/mole logk: 4.43E+3
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36254(2-chloro-4-[(4-hydroxyphenyl)azo]benzoate)
ITC DataΔG°: -20.8kJ/mole −TΔS°: -7.81kJ/mole ΔH°: -12.9kJ/mole logk: 4.37E+3
T: 24.85°C 
Syringe InfoChEBI
PC cidPC sid
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36251(FC4+Br-)
ITC DataΔG°: -20.6kJ/mole −TΔS°: 4.05kJ/mole ΔH°: -24.7kJ/mole logk: 4.14E+3
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36165(cholate (CA))
ITC DataΔG°: -20.6kJ/mole −TΔS°: 2.39kJ/mole ΔH°: -23.0kJ/mole logk: 4.07E+3
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36055((R)-3-bromo-8-camphorsulfonic acid)
ITC DataΔG°: -20.4kJ/mole −TΔS°: 9.69kJ/mole ΔH°: -30.1kJ/mole logk: 3.76E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36056((S)-3-bromo-8-camphorsulfonic acid)
ITC DataΔG°: -20.3kJ/mole −TΔS°: 9.30kJ/mole ΔH°: -29.6kJ/mole logk: 3.64E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36255(4-chloro-3-[(4-hydroxyphenyl)azo]benzoate)
ITC DataΔG°: -20.0kJ/mole ΔH°: -20.1kJ/mole logk: 3.24E+3
T: 24.85°C 
Syringe InfoChEBI
PC cidPC sid
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -19.7kJ/mole −TΔS°: 8.79kJ/mole ΔH°: -28.5kJ/mole logk: 2.90E+3
pH: 5.5 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36065((R)-camphorquinone-3-oxime)
ITC DataΔG°: -19.5kJ/mole −TΔS°: 7.60kJ/mole ΔH°: -27.1kJ/mole logk: 2.61E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM50029034(1-naphthalenesulfonate | alpha-naphthalenesulfonat...)
ITC DataΔG°: -19.4kJ/mole −TΔS°: -13.2kJ/mole ΔH°: -6.24kJ/mole logk: 2.50E+3
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM50060533(1,12-Bis(trimethyl ammonium)dodecane dibromide | 1...)
ITC DataΔG°: -19.4kJ/mole −TΔS°: -9.71kJ/mole ΔH°: -9.70kJ/mole logk: 1.95E+3
T: 35.05°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36065((R)-camphorquinone-3-oxime)
ITC DataΔG°: -19.4kJ/mole −TΔS°: 7.69kJ/mole ΔH°: -27kJ/mole logk: 2.45E+3
pH: 4.8 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36066((S)-camphorquinone-3-oxime)
ITC DataΔG°: -19.3kJ/mole −TΔS°: 7.90kJ/mole ΔH°: -27.2kJ/mole logk: 2.44E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36262(alkyldimethyl(ferrocenylmethy1)ammonium (3))
ITC DataΔG°: -19.3kJ/mole −TΔS°: 6.29kJ/mole ΔH°: -25.5kJ/mole logk: 2.50E+3
pH: 6.5 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36260(alkyldimethyl(ferrocenylmethy1)ammonium (2+))
ITC DataΔG°: -19.3kJ/mole −TΔS°: 4.62kJ/mole ΔH°: -23.9kJ/mole logk: 2.50E+3
pH: 5.5 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36085((1R,2R,5R)-2-hydroxy-3-pinanone)
ITC DataΔG°: -19.3kJ/mole −TΔS°: 0.209kJ/mole ΔH°: -19.5kJ/mole logk: 2.36E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36169(glycocholate (GCA))
ITC DataΔG°: -19.3kJ/mole −TΔS°: 3.70kJ/mole ΔH°: -23.0kJ/mole logk: 2.39E+3
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36178(cycloheptanol)
ITC DataΔG°: -19.2kJ/mole −TΔS°: -7.63kJ/mole ΔH°: -11.6kJ/mole logk: 2.34E+3
pH: 7.2 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36066((S)-camphorquinone-3-oxime)
ITC DataΔG°: -19.2kJ/mole −TΔS°: 7.90kJ/mole ΔH°: -27.1kJ/mole logk: 2.34E+3
pH: 4.8 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36178(cycloheptanol)
ITC DataΔG°: -19.2kJ/mole −TΔS°: -7.45kJ/mole ΔH°: -11.8kJ/mole logk: 2.32E+3
pH: 6.9 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36086((1S,2S,5S)-2-hydroxy-3-pinanone)
ITC DataΔG°: -19.2kJ/mole −TΔS°: 0.805kJ/mole ΔH°: -20kJ/mole logk: 2.31E+3
pH: 6.9 T: 25.00°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36170(taurocholate (TCA))
ITC DataΔG°: -19.2kJ/mole −TΔS°: 4.59kJ/mole ΔH°: -23.8kJ/mole logk: 2.29E+3
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36178(cycloheptanol)
ITC DataΔG°: -19.1kJ/mole −TΔS°: -6.71kJ/mole ΔH°: -12.4kJ/mole logk: 2.20E+3
pH: 6.9 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36178(cycloheptanol)
ITC DataΔG°: -19.1kJ/mole −TΔS°: -6.71kJ/mole ΔH°: -12.4kJ/mole logk: 2.20E+3
pH: 6.9 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36193(trans-4-methylcyclohexanol)
ITC DataΔG°: -19kJ/mole −TΔS°: -9.93kJ/mole ΔH°: -9.06kJ/mole logk: 2.13E+3
pH: 6.9 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36011(4-benzylpiperidine)
ITC DataΔG°: -18.8kJ/mole −TΔS°: -5.10kJ/mole ΔH°: -13.8kJ/mole logk: 2.00E+3
pH: 6.9 T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36149(2,6-naphthalenedisulfonate | CHEMBL319726)
ITC DataΔG°: -18.8kJ/mole −TΔS°: -7.13kJ/mole ΔH°: -11.7kJ/mole logk: 1.95E+3
pH: 7.2 T: 25.00°C 
In DepthDetails Article
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36145(cis-4-Methylcyclohexanol)
ITC DataΔG°: -18.5kJ/mole −TΔS°: -1.72kJ/mole ΔH°: -16.8kJ/mole logk: 1.08E+3
pH: 6.9 T: 45.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36145(cis-4-Methylcyclohexanol)
ITC DataΔG°: -18.5kJ/mole −TΔS°: -5.42kJ/mole ΔH°: -13.1kJ/mole logk: 1.33E+3
pH: 6.9 T: 35.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36259((ferrocenemethyl)trimethylamine, 3+ | alkyldimethy...)
ITC DataΔG°: -18.4kJ/mole −TΔS°: 7.12kJ/mole ΔH°: -25.5kJ/mole logk: 1.58E+3
T: 24.85°C 
In DepthDetails
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36145(cis-4-Methylcyclohexanol)
ITC DataΔG°: -18.1kJ/mole −TΔS°: -8.50kJ/mole ΔH°: -9.63kJ/mole logk: 1.47E+3
pH: 6.9 T: 25.00°C 
HostPNGBDBM11(beta-cyclodextrin | betadex)
Himeji Institute of Technology

GuestPNGBDBM36145(cis-4-Methylcyclohexanol)
ITC DataΔG°: -18.1kJ/mole −TΔS°: -8.56kJ/mole ΔH°: -9.5kJ/mole logk: 1.46E+3
pH: 6.9 T: 25.00°C 
In DepthDetails Article
  • Reorder this table by ΔH°
  • Reorder this table by ΔS°
  • Reorder this table by pH
  • Reorder this table by T
  • Change energy unit to:  kcal/mol