N-(1-adamantyl)acetamide
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
193.29 2 1 2.48 SF_C62 None Not checked

SMILES: CC(=O)NC12CC3CC(CC(C3)C1)C2

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[N-(1-adamantyl)acetamide] 4.56 3.48 7.0 25.0 Mass spectrometry, UV-vis spectrometry Willem Verboom 2005

N-(1-adamantylmethyl)-
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None NT_b0175 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[N-(1-adamantylmethyl)-] 2.00 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[b-Cyclodextrin](1).[N-(1-adamantylmethyl)-] 4.45 3.48 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[g-Cyclodextrin](1).[N-(1-adamantylmethyl)-] 2.81 1.70 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin isomeric purity >80 %](1).[N-(1-adamantylmethyl)-] 4.04 3.00 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[MolecusolTM](1).[N-(1-adamantylmethyl)-] 3.95 3.00 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003

N-(3,5-dinitrobenzoyl)-D-homophenylalanine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
373.32 6 2 3.76 NT_b0109 None Not checked

SMILES: OC(=O)[C@@H](CCc1ccccc1)NC(=O)c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[N-(3,5-dinitrobenzoyl)-D-homophenylalanine] 2.66 1.00 6.5 22.0 capillar zone electrophoresis Apryll M. Stalcup 1995

N-(3,5-dinitrobenzoyl)-D-phenylglycine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
345.26 6 2 3.50 NT_b0111 None Not checked

SMILES: O=C(O)[C@@H](C1=CC=CC=C1)NC(C2=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C2)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[N-(3,5-dinitrobenzoyl)-D-phenylglycine] 2.21 0.48 6.5 22.0 capillar zone electrophoresis Apryll M. Stalcup 1995

N-(3,5-dinitrobenzoyl)-L-homophenylalanine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
373.32 6 2 3.76 NT_b0108 None Not checked

SMILES: OC(=O)[C@H](CCc1ccccc1)NC(=O)c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[N-(3,5-dinitrobenzoyl)-L-homophenylalanine] 2.67 0.95 6.5 22.0 capillar zone electrophoresis Apryll M. Stalcup 1995

N-(3,5-dinitrobenzoyl)-L-phenylglycine
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
345.26 6 2 3.50 NT_b0110 None Not checked

SMILES: O=C(O)[C@H](C1=CC=CC=C1)NC(C2=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C2)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[N-(3,5-dinitrobenzoyl)-L-phenylglycine] 2.41 0.60 6.5 22.0 capillar zone electrophoresis Apryll M. Stalcup 1995

N-(3,5-dinitrobenzoyl)phenylalanin
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
359.29 6 2 3.37 NT_b0112 None Not checked

SMILES: OC(=O)[C@H](Cc1ccccc1)NC(=O)c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[b-Cyclodextrin](1).[N-(3,5-dinitrobenzoyl)phenylalanin] 1.63 0.60 6.5 22.0 capillar zone electrophoresis Apryll M. Stalcup 1995

N-(4-tert-butyl benzyl)-
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None NT_b0177 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[N-(4-tert-butyl benzyl)-] 2.00 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[b-Cyclodextrin](1).[N-(4-tert-butyl benzyl)-] 3.97 2.78 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[g-Cyclodextrin](1).[N-(4-tert-butyl benzyl)-] 2.30 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[Heptakis(2,6-di-O-Methyl)-b-Cyclodextrin isomeric purity >80 %](1).[N-(4-tert-butyl benzyl)-] 3.72 2.48 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003
[MolecusolTM](1).[N-(4-tert-butyl benzyl)-] 3.76 2.70 7.0 25.0 surface plasmon resonance (SPR) Susan E. Brown 2003

N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
None None VD-0082 None

SMILES:

Supramolecules

Namelog KSDpHT(°C)MethodRef
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](1).[ammonium 8-anilino-1-naphthalenesulfonate] 3.51 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](2).[ammonium 8-anilino-1-naphthalenesulfonate] 3.54 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](1).[sodium 6-toluidino-2-naphthalenesulfonate] 4.67 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](2).[sodium 6-toluidino-2-naphthalenesulfonate] 4.03 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](1).[acridine red] 3.27 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](2).[acridine red] 3.20 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](1).[rhodamine B] 3.84 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004
[N-(benzoaza-15-crown-5)acylaminomethylene tethered 6-diethylenetriamino-6-deoxy-b-CD](2).[rhodamine B] 4.26 7.2 25.0 Fluorescence spectroscopy Yu Liu 2004

N-Acetyl-L-leucinamide
MW HBA HBD LogP CAS Suppliers Supplier IDs Storage ID Quantity Class PAINS
172.22 4 2 1.11 nt0008 None Not checked

SMILES: CC(C)C[C@H](N)C(=O)NC(C)=O

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[N-Acetyl-L-leucinamide] 1.30 25.0 Kenneth A. Connors 1995