meso-tetra(4-carboxyphenyl)porphyrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
790.77 10 6 5.66 JN_AK_1 None Not checked

SMILES: C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C(=O)O)C=C4)C9=CC=C(C=C9)C(=O)O)N3)C(=O)O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[meso-tetra(4-carboxyphenyl)porphyrin] 16.60 UV-Vis spectroscopy John T. Groves 2004
[6A-N-dansylpermethylated-ß-cyclodextrin (Dan-NH-TMCD)](2).[meso-tetra(4-carboxyphenyl)porphyrin] 16.15 fluorescence titration John T. Groves 2004
[heptakis(2,3,6-tri-O-2-(2-(2-methoxyethoxy)ethoxy)ethyl)-β-cyclodextrin ](1).[meso-tetra(4-carboxyphenyl)porphyrin] 8.00 NMR spectroscopy John T. Groves 2004

meso-tetrakis(4-N-ethylpyridiumyl) porphyrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None JN_T_1 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[meso-tetrakis(4-N-ethylpyridiumyl) porphyrin] 2.74 7.61 20.0 UV-vis and fluorescence spectroscopy Shuang Shaomin 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[meso-tetrakis(4-N-ethylpyridiumyl) porphyrin] 4.04 7.61 20.0 UV-vis and fluorescence spectroscopy Shuang Shaomin 2005
[sulfobutylether-b-cyclodextrin](1).[meso-tetrakis(4-N-ethylpyridiumyl) porphyrin] 5.30 7.61 20.0 UV-vis and fluorescence spectroscopy Shuang Shaomin 2005

meso-tetrakis(4-N-methylpyridiumyl) porphyrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None JN_T_2 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[meso-tetrakis(4-N-methylpyridiumyl) porphyrin] 5.48 7.61 20.0 UV-vis and fluorescence spectroscopy Shuang Shaomin 2005
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[meso-tetrakis(4-N-methylpyridiumyl) porphyrin] 5.05 7.61 20.0 UV-vis and fluorescence spectroscopy Shuang Shaomin 2005
[sulfobutylether-b-cyclodextrin](1).[meso-tetrakis(4-N-methylpyridiumyl) porphyrin] 4.58 7.61 20.0 UV-vis and fluorescence spectroscopy Shuang Shaomin 2005

meso-tetrakis(4-sulfonatophenyl)porphyrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
930.96 10 2 6.81 SF_C583 None Not checked

SMILES: O=S(C1=CC=C(C2=C3C=CC(C(C4=CC=C(S(=O)([O-])=O)C=C4)=C5C=CC(N5)=C(C6=CC=C(S(=O)([O-])=O)C=C6)C(C=C7)=NC7=C(C8=CC=C(S(=O)([O-])=O)C=C8)C9=CC=C2N9)=N3)C=C1)([O-])=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[meso-tetrakis(4-sulfonatophenyl)porphyrin] 4.49 3.60 7.0 25.0 Isothermal titration calorymetry Anthony L. Spek 2004
[Dithienylethene-tethered b-cyclodextrin dimer (opened form)](2).[meso-tetrakis(4-sulfonatophenyl)porphyrin] 6.52 5.60 7.0 25.0 Isothermal titration calorymetry Anthony L. Spek 2004
[Dithienylethene-tethered b-cyclodextrin dimer (closed form)](2).[meso-tetrakis(4-sulfonatophenyl)porphyrin] 4.99 4.11 7.0 25.0 Isothermal titration calorymetry Anthony L. Spek 2004

meso-tetraphenylporphyrin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
614.74 2 2 6.87 JN_AD_1 None Not checked

SMILES: [nH]1c2ccc1c(c3ccccc3)c4ccc(n4)c(c5ccccc5)c6ccc(n6)c(c7[nH]c(cc7)c2c8ccccc8)c9ccccc9

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](2).[meso-tetraphenylporphyrin] 2.68 20.0 fluorescence spectroscopy Ke’an Li 2002
[heptakis(2,6-di-O-n-octyl)BCD](2).[meso-tetraphenylporphyrin] 8.92 20.0 fluorescence spectroscopy Ke’an Li 2002

metallobridged bis(b-cyclodextrin)s der. 6
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0175 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[metallobridged bis(b-cyclodextrin)s der. 6](1).[ammonium 8-anilino-1-naphthalenesulfonate] 3.51 7.2 25.0 UV-vis spectroscopy Yu Liu 2003
[metallobridged bis(b-cyclodextrin)s der. 6](1).[sodium 6-p-toluidino-2-naphthalenesulfonic acid] 4.32 7.2 25.0 UV-vis spectroscopy Yu Liu 2003

metallobridged bis(b-cyclodextrin)s der. 7
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0176 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[metallobridged bis(b-cyclodextrin)s der. 7](1).[ammonium 8-anilino-1-naphthalenesulfonate] 3.64 7.2 25.0 UV-vis spectroscopy Yu Liu 2003
[metallobridged bis(b-cyclodextrin)s der. 7](1).[sodium 6-p-toluidino-2-naphthalenesulfonic acid] 4.70 7.2 25.0 UV-vis spectroscopy Yu Liu 2003

metallobridged bis(b-cyclodextrin)s der. 8
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0177 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[metallobridged bis(b-cyclodextrin)s der. 8](1).[ammonium 8-anilino-1-naphthalenesulfonate] 3.76 7.2 25.0 UV-vis spectroscopy Yu Liu 2003
[metallobridged bis(b-cyclodextrin)s der. 8](1).[sodium 6-p-toluidino-2-naphthalenesulfonic acid] 4.39 7.2 25.0 UV-vis spectroscopy Yu Liu 2003

metallobridged bis(b-cyclodextrin)s der. 9
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0178 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[metallobridged bis(b-cyclodextrin)s der. 9](1).[ammonium 8-anilino-1-naphthalenesulfonate] 3.39 7.2 25.0 UV-vis spectroscopy Yu Liu 2003
[metallobridged bis(b-cyclodextrin)s der. 9](1).[sodium 6-p-toluidino-2-naphthalenesulfonic acid] 4.19 7.2 25.0 UV-vis spectroscopy Yu Liu 2003

methanethiol
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
48.11 1 1 0.55 SF_C445 None Not checked

SMILES: CS

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[methanethiol] 1.36 -0.52 22.0 HS-GCMS Daniel W. Armstrong 2006
[b-Cyclodextrin](1).[methanethiol] 0.23 -0.33 22.0 HS-GCMS Daniel W. Armstrong 2006
[g-Cyclodextrin](1).[methanethiol] 0.40 -1.00 22.0 HS-GCMS Daniel W. Armstrong 2006
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[methanethiol] 0.28 -0.92 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-a-Cyclodextrin](1).[methanethiol] -0.12 -0.89 22.0 HS-GCMS Daniel W. Armstrong 2006
[Sulfated-b-Cyclodextrin](1).[methanethiol] -0.74 -1.22 22.0 HS-GCMS Daniel W. Armstrong 2006
[Carboxymethylated-b-Cyclodextrin (DS ~3.5)](1).[methanethiol] -0.46 -1.15 22.0 HS-GCMS Daniel W. Armstrong 2006