Compile Data Set for Download or QSAR

Found 11 hits with all data for this entryid   

HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM197283(SAMPL3, G6)
ITC DataΔG°: -44.9kJ/mole logk: 6.50E+7
pH: 7.4 T: 24.85°C 
HostPNGBDBM36284(SAMPL3, H3 | BDBM36303 | Methyl Viologen-Cucurbit[...)
University of California San Diego

GuestPNGBDBM197285(SAMPL3, G8)
ITC DataΔG°: -40.2kJ/mole −TΔS°: -9.90kJ/mole ΔH°: -30kJ/mole logk: 1.00E+7
pH: 7.0 T: 26.85°C 
HostPNGBDBM36284(SAMPL3, H3 | BDBM36303 | Methyl Viologen-Cucurbit[...)
University of California San Diego

GuestPNGBDBM197286(SAMPL3, G9)
ITC DataΔG°: -37.6kJ/mole −TΔS°: -20.1kJ/mole ΔH°: -18kJ/mole logk: 3.60E+6
pH: 7.0 T: 26.85°C 
HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM197284(SAMPL3, G7)
ITC DataΔG°: -32.9kJ/mole logk: 5.30E+7
pH: 7.4 T: 24.85°C 
HostPNGBDBM36281(BDBM197279 | cucurbit[7]uril)
University of California San Diego

GuestPNGBDBM197286(SAMPL3, G9)
ITC DataΔG°: -31.1kJ/mole −TΔS°: -15kJ/mole ΔH°: -16kJ/mole logk: 2.60E+5
pH: 7.0 T: 26.85°C 
HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM64452(2-(diethylamino)ethyl 4-azanylbenzoate hydrochlori...)
ITC DataΔG°: -29.7kJ/mole logk: 1.50E+5
pH: 7.4 T: 24.85°C 
HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM197281(SAMPL3, G3)
ITC DataΔG°: -28.5kJ/mole logk: 9.00E+4
pH: 7.4 T: 24.85°C 
HostPNGBDBM36281(BDBM197279 | cucurbit[7]uril)
University of California San Diego

GuestPNGBDBM197285(SAMPL3, G8)
ITC DataΔG°: -25.6kJ/mole −TΔS°: 9.90kJ/mole ΔH°: -36kJ/mole logk: 2.90E+4
pH: 7.0 T: 26.85°C 
HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM50017662(CHEMBL79 | N-(2,6-dimethylphenyl)-N(2),N(2)-diethy...)
ITC DataΔG°: -25.4kJ/mole logk: 2.60E+4
pH: 7.4 T: 24.85°C 
HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM50350790(Bupivacaine | BUPIVACAINE HYDROCHLORIDE | SAMPL3, ...)
ITC DataΔG°: -24.5kJ/mole logk: 1.80E+4
pH: 7.4 T: 24.85°C 
HostPNGBDBM197280(SAMPL3, H1)
University of California San Diego

GuestPNGBDBM197282(SAMPL3, G4)
ITC DataΔG°: -17.5kJ/mole logk: 1.10E+3
pH: 7.4 T: 24.85°C 
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