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Compile Data Set for Download or QSAR

Found 62 hits of ic50 data for polymerid = 49000249,49000250,49000251   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055252
PNG
(CHEMBL3323657)
Show SMILES CC(C)[C@H]1CCC[C@H]1NC[C@H](O)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1/C17H24N2O3S/c1-9(2)10-4-3-5-12(10)18-8-14(21)11-6-7-13(20)15-16(11)23-17(22)19-15/h6-7,9-10,12,14,18,20-21H,3-5,8H2,1-2H3,(H,19,22)/t10-,12-,14+/s2
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n/an/a<0.300n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50324856
PNG
(7-((R)-2-((cis)-bi(cyclopentan)-2-ylamino)-1-hydro...)
Show SMILES O[C@@H](CN[C@@H]1CCC[C@@H]1C1CCCC1)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1S/C19H26N2O3S/c22-15-9-8-13(18-17(15)21-19(24)25-18)16(23)10-20-14-7-3-6-12(14)11-4-1-2-5-11/h8-9,11-12,14,16,20,22-23H,1-7,10H2,(H,21,24)/t12-,14-,16+/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318156
PNG
(CHEMBL1094785 | carmoterol)
Show SMILES COc1ccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1
Show InChI InChI=1S/C21H24N2O4/c1-13(11-14-3-5-15(27-2)6-4-14)22-12-19(25)16-7-9-18(24)21-17(16)8-10-20(26)23-21/h3-10,13,19,22,24-25H,11-12H2,1-2H3,(H,23,26)/t13-,19+/m1/s1
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n/an/a 0.300n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50151720
PNG
(ARFORMOTEROL TARTRATE | CHEMBL1363 | CHEMBL605993 ...)
Show SMILES COc1ccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c(NC=O)c2)cc1
Show InChI InChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)/t13-,19+/m1/s1
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n/an/a 0.400n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM86453
PNG
(CAS_73573-87-2 | Formoterol | NSC_3083544)
Show SMILES COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1
Show InChI InChI=1S/C19H24N2O4/c1-13(9-14-3-6-16(25-2)7-4-14)20-11-19(24)15-5-8-18(23)17(10-15)21-12-22/h3-8,10,12-13,19-20,23-24H,9,11H2,1-2H3,(H,21,22)
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n/an/a 0.400n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318161
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(indan-2-ylamino)-eth...)
Show SMILES O[C@@H](CNC1Cc2ccccc2C1)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C20H20N2O3/c23-17-7-5-15(16-6-8-19(25)22-20(16)17)18(24)11-21-14-9-12-3-1-2-4-13(12)10-14/h1-8,14,18,21,23-24H,9-11H2,(H,22,25)/t18-/m0/s1
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n/an/a 0.830n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50324855
PNG
(7-((R)-2-((1S,2S)-2-(benzyloxy)cyclopentylamino)-1...)
Show SMILES O[C@@H](CN[C@H]1CCC[C@@H]1OCc1ccccc1)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1S/C21H24N2O4S/c24-16-10-9-14(20-19(16)23-21(26)28-20)17(25)11-22-15-7-4-8-18(15)27-12-13-5-2-1-3-6-13/h1-3,5-6,9-10,15,17-18,22,24-25H,4,7-8,11-12H2,(H,23,26)/t15-,17-,18-/m0/s1
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n/an/a 2.20n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318155
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(5,6-dimethoxyindan-2...)
Show SMILES COc1cc2CC(Cc2cc1OC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C22H24N2O5/c1-28-19-9-12-7-14(8-13(12)10-20(19)29-2)23-11-18(26)15-3-5-17(25)22-16(15)4-6-21(27)24-22/h3-6,9-10,14,18,23,25-26H,7-8,11H2,1-2H3,(H,24,27)/t18-/m0/s1
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n/an/a 2.30n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM25771
PNG
(1-hydroxy-2-naphthoic acid;4-[1-hydroxy-2-[6-(4-ph...)
Show SMILES OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1
Show InChI InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2
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n/an/a 3.5n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM25771
PNG
(1-hydroxy-2-naphthoic acid;4-[1-hydroxy-2-[6-(4-ph...)
Show SMILES OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1
Show InChI InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2
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n/an/a 3.5n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50421325
PNG
(CHEMBL2088197)
Show SMILES CCc1cc2CC(Cc2cc1CC)NC[C@H](O)c1ccc(O)c2NC(=O)CCc12
Show InChI InChI=1S/C24H30N2O3/c1-3-14-9-16-11-18(12-17(16)10-15(14)4-2)25-13-22(28)19-5-7-21(27)24-20(19)6-8-23(29)26-24/h5,7,9-10,18,22,25,27-28H,3-4,6,8,11-13H2,1-2H3,(H,26,29)/t22-/m0/s1
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n/an/a 3.90n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2-adrenoceptor in guinea-pig tracheal-strip assessed as inhibition of electrically-stimulated muscle contraction


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055251
PNG
(CHEMBL3323655)
Show SMILES O[C@@H](CN[C@@H]1CCC[C@@H]1C1CCCCC1)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1/C20H28N2O3S/c23-16-10-9-14(19-18(16)22-20(25)26-19)17(24)11-21-15-8-4-7-13(15)12-5-2-1-3-6-12/h9-10,12-13,15,17,21,23-24H,1-8,11H2,(H,22,25)/t13-,15-,17+/s2
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n/an/a 5.70n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055245
PNG
(CHEMBL3323668)
Show SMILES CCCCc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1
Show InChI InChI=1/C21H26N2O3S/c1-2-3-5-14-6-4-7-15(12-14)10-11-22-13-18(25)16-8-9-17(24)19-20(16)27-21(26)23-19/h4,6-9,12,18,22,24-25H,2-3,5,10-11,13H2,1H3,(H,23,26)/t18-/s2
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n/an/a 6.40n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318159
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(5,6-diethylindan-2-y...)
Show SMILES CCc1cc2CC(Cc2cc1CC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C24H28N2O3/c1-3-14-9-16-11-18(12-17(16)10-15(14)4-2)25-13-22(28)19-5-7-21(27)24-20(19)6-8-23(29)26-24/h5-10,18,22,25,27-28H,3-4,11-13H2,1-2H3,(H,26,29)/t22-/m0/s1
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n/an/a 7.90n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318159
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(5,6-diethylindan-2-y...)
Show SMILES CCc1cc2CC(Cc2cc1CC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C24H28N2O3/c1-3-14-9-16-11-18(12-17(16)10-15(14)4-2)25-13-22(28)19-5-7-21(27)24-20(19)6-8-23(29)26-24/h5-10,18,22,25,27-28H,3-4,11-13H2,1-2H3,(H,26,29)/t22-/m0/s1
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n/an/a 7.90n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055249
PNG
(CHEMBL3323670)
Show SMILES CCCCOc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1
Show InChI InChI=1/C21H26N2O4S/c1-2-3-11-27-15-6-4-5-14(12-15)9-10-22-13-18(25)16-7-8-17(24)19-20(16)28-21(26)23-19/h4-8,12,18,22,24-25H,2-3,9-11,13H2,1H3,(H,23,26)/t18-/s2
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n/an/a 8.5n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055254
PNG
(CHEMBL3323666)
Show SMILES CCCc1cccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)c1
Show InChI InChI=1/C20H24N2O3S/c1-2-4-13-5-3-6-14(11-13)9-10-21-12-17(24)15-7-8-16(23)18-19(15)26-20(25)22-18/h3,5-8,11,17,21,23-24H,2,4,9-10,12H2,1H3,(H,22,25)/t17-/s2
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n/an/a 12n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055253
PNG
(CHEMBL3323659)
Show SMILES O[C@@H](CN[C@@H]1CCC[C@@H]1c1ccccc1)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1/C20H22N2O3S/c23-16-10-9-14(19-18(16)22-20(25)26-19)17(24)11-21-15-8-4-7-13(15)12-5-2-1-3-6-12/h1-3,5-6,9-10,13,15,17,21,23-24H,4,7-8,11H2,(H,22,25)/t13-,15-,17+/s2
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n/an/a 12n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055255
PNG
(CHEMBL3323665)
Show SMILES CCCc1ccc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)sc23)cc1
Show InChI InChI=1/C20H24N2O3S/c1-2-3-13-4-6-14(7-5-13)10-11-21-12-17(24)15-8-9-16(23)18-19(15)26-20(25)22-18/h4-9,17,21,23-24H,2-3,10-12H2,1H3,(H,22,25)/t17-/s2
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n/an/a 14n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM25769
PNG
(4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxym...)
Show SMILES CC(C)(C)NCC(O)c1ccc(O)c(CO)c1
Show InChI InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3
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n/an/a 17n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055256
PNG
(CHEMBL3323663)
Show SMILES CCc1cccc(c1)[C@H]1CCC[C@H]1NC[C@H](O)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1/C22H26N2O3S/c1-2-13-5-3-6-14(11-13)15-7-4-8-17(15)23-12-19(26)16-9-10-18(25)20-21(16)28-22(27)24-20/h3,5-6,9-11,15,17,19,23,25-26H,2,4,7-8,12H2,1H3,(H,24,27)/t15-,17-,19+/s2
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n/an/a 20n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318158
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(5,6-di-n-propylindan...)
Show SMILES CCCc1cc2CC(Cc2cc1CCC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C26H32N2O3/c1-3-5-16-11-18-13-20(14-19(18)12-17(16)6-4-2)27-15-24(30)21-7-9-23(29)26-22(21)8-10-25(31)28-26/h7-12,20,24,27,29-30H,3-6,13-15H2,1-2H3,(H,28,31)/t24-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055258
PNG
(CHEMBL3323661)
Show SMILES Cc1cccc(c1)[C@H]1CCC[C@H]1NC[C@H](O)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1/C21H24N2O3S/c1-12-4-2-5-13(10-12)14-6-3-7-16(14)22-11-18(25)15-8-9-17(24)19-20(15)27-21(26)23-19/h2,4-5,8-10,14,16,18,22,24-25H,3,6-7,11H2,1H3,(H,23,26)/t14-,16-,18+/s2
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n/an/a 22n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50055250
PNG
(CHEMBL3323653)
Show SMILES O[C@@H](CN[C@H]1CCC[C@H]1C1CCCC1)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1/C19H26N2O3S/c22-15-9-8-13(18-17(15)21-19(24)25-18)16(23)10-20-14-7-3-6-12(14)11-4-1-2-5-11/h8-9,11-12,14,16,20,22-23H,1-7,10H2,(H,21,24)/t12-,14-,16-/s2
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n/an/a 23n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in electrically-stimulated Dunkin-Hartley guinea pig tracheal strip assessed as inhibition of contracti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM25761
PNG
(Anapriline | Avlocardyl | CHEMBL27 | PROPANOLOL(-)...)
Show SMILES CC(C)NCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3
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n/an/a 28.8n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-2 adrenergic receptor in guinea pig tracheal strip is determined


J Med Chem 36: 3077-86 (1993)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017384
PNG
(9a-Methoxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES COC12CCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C21H32N2O3/c1-20(2,3)22-13-15(24)14-26-23-19-17-10-6-5-9-16(17)18-11-7-8-12-21(18,19)25-4/h5-6,9-10,15,18,22,24H,7-8,11-14H2,1-4H3/b23-19-
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n/an/a 35n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017392
PNG
(9a-Methoxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES COC12CCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C21H32N2O3/c1-15(2)22-13-16(24)14-26-23-20-18-10-7-6-9-17(18)19-11-5-4-8-12-21(19,20)25-3/h6-7,9-10,15-16,19,22,24H,4-5,8,11-14H2,1-3H3/b23-20-
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n/an/a 35n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318160
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(5,6-dimethylindan-2-...)
Show SMILES Cc1cc2CC(Cc2cc1C)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C22H24N2O3/c1-12-7-14-9-16(10-15(14)8-13(12)2)23-11-20(26)17-3-5-19(25)22-18(17)4-6-21(27)24-22/h3-8,16,20,23,25-26H,9-11H2,1-2H3,(H,24,27)/t20-/m0/s1
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n/an/a 48n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50131280
PNG
(5-(2-{2-[4-(2-Fluoro-ethoxy)-phenyl]-1-methyl-ethy...)
Show SMILES CC(Cc1ccc(OCCF)cc1)NCC(O)c1cc(O)cc(O)c1
Show InChI InChI=1S/C19H24FNO4/c1-13(8-14-2-4-18(5-3-14)25-7-6-20)21-12-19(24)15-9-16(22)11-17(23)10-15/h2-5,9-11,13,19,21-24H,6-8,12H2,1H3
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n/an/a 60n/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration of the compound Beta-2 adrenergic receptor in Guinea pig trachea


Bioorg Med Chem Lett 13: 2687-92 (2003)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50131281
PNG
(5-(1-hydroxy-2-(1-(4-hydroxyphenyl)propan-2-ylamin...)
Show SMILES CC(Cc1ccc(O)cc1)NCC(O)c1cc(O)cc(O)c1
Show InChI InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3
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n/an/a 60n/an/an/an/an/an/a



University of Mainz

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration of the compound Beta-2 adrenergic receptor in Guinea pig trachea


Bioorg Med Chem Lett 13: 2687-92 (2003)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318154
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(4,7-diethylindan-2-y...)
Show SMILES CCc1ccc(CC)c2CC(Cc12)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C24H28N2O3/c1-3-14-5-6-15(4-2)20-12-16(11-19(14)20)25-13-22(28)17-7-9-21(27)24-18(17)8-10-23(29)26-24/h5-10,16,22,25,27-28H,3-4,11-13H2,1-2H3,(H,26,29)/t22-/m0/s1
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n/an/a 75n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50421326
PNG
(CHEMBL2088198)
Show SMILES CCc1cc2CC(Cc2cc1CC)NCCc1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C24H28N2O2/c1-3-15-11-18-13-20(14-19(18)12-16(15)4-2)25-10-9-17-5-7-22(27)24-21(17)6-8-23(28)26-24/h5-8,11-12,20,25,27H,3-4,9-10,13-14H2,1-2H3,(H,26,28)
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n/an/a 240n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2-adrenoceptor in guinea-pig tracheal-strip assessed as inhibition of electrically-stimulated muscle contraction


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036842
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-prop...)
Show SMILES CCCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-14-12-8-9(13)7-11-10(2,3)4/h8-9,11,13H,5-7H2,1-4H3/b12-8+
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n/an/a 269n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017388
PNG
(9a-Methoxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES COC12CCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C20H30N2O3/c1-14(2)21-12-15(23)13-25-22-19-17-9-5-4-8-16(17)18-10-6-7-11-20(18,19)24-3/h4-5,8-9,14-15,18,21,23H,6-7,10-13H2,1-3H3/b22-19-
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n/an/a 300n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017383
PNG
(9a-Methoxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES COC12CCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C22H34N2O3/c1-21(2,3)23-14-16(25)15-27-24-20-18-11-8-7-10-17(18)19-12-6-5-9-13-22(19,20)26-4/h7-8,10-11,16,19,23,25H,5-6,9,12-15H2,1-4H3/b24-20-
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n/an/a 440n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017385
PNG
(9a-Hydroxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12O
Show InChI InChI=1S/C21H32N2O3/c1-20(2,3)22-13-15(24)14-26-23-19-17-10-7-6-9-16(17)18-11-5-4-8-12-21(18,19)25/h6-7,9-10,15,18,22,24-25H,4-5,8,11-14H2,1-3H3/b23-19-
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n/an/a 440n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017396
PNG
(7-Fluoro-9a-methoxy-1,2,3,4,4a,9a-hexahydro-fluore...)
Show SMILES COC12CCCCC1c1ccc(F)cc1\C2=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C21H31FN2O3/c1-20(2,3)23-12-15(25)13-27-24-19-17-11-14(22)8-9-16(17)18-7-5-6-10-21(18,19)26-4/h8-9,11,15,18,23,25H,5-7,10,12-13H2,1-4H3/b24-19-
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n/an/a 450n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017386
PNG
(7-Fluoro-9a-methoxy-1,2,3,4,4a,9a-hexahydro-fluore...)
Show SMILES COC12CCCCC1c1ccc(F)cc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C20H29FN2O3/c1-13(2)22-11-15(24)12-26-23-19-17-10-14(21)7-8-16(17)18-6-4-5-9-20(18,19)25-3/h7-8,10,13,15,18,22,24H,4-6,9,11-12H2,1-3H3/b23-19-
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n/an/a 790n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036841
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-ethy...)
Show SMILES CCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-13-11-7-8(12)6-10-9(2,3)4/h7-8,10,12H,5-6H2,1-4H3/b11-7+
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n/an/a 977n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036835
PNG
(1-(3,4-Dichloro-phenyl)-2-isopropylamino-ethanol |...)
Show SMILES CC(C)NCC(O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C11H15Cl2NO/c1-7(2)14-6-11(15)8-3-4-9(12)10(13)5-8/h3-5,7,11,14-15H,6H2,1-2H3
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n/an/a 977n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50318157
PNG
(8-Hydroxy-5-[(R)-1-hydroxy-2-(5,6-di-n-butylindan-...)
Show SMILES CCCCc1cc2CC(Cc2cc1CCCC)NC[C@H](O)c1ccc(O)c2[nH]c(=O)ccc12
Show InChI InChI=1S/C28H36N2O3/c1-3-5-7-18-13-20-15-22(16-21(20)14-19(18)8-6-4-2)29-17-26(32)23-9-11-25(31)28-24(23)10-12-27(33)30-28/h9-14,22,26,29,31-32H,3-8,15-17H2,1-2H3,(H,30,33)/t26-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Novartis Institutes for Biomedical Research

Curated by ChEMBL


Assay Description
Agonist activity at beta2 adrenergic receptor in guinea pig tracheal strip assessed as inhibition of electrically-induced bronchocontractile response...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036840
PNG
(CHEMBL38033 | Propionaldehyde O-(3-tert-butylamino...)
Show SMILES CC\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-12-14-8-9(13)7-11-10(2,3)4/h6,9,11,13H,5,7-8H2,1-4H3/b12-6+
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n/an/a 1.55E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017390
PNG
(9a-(2-Hydroxy-ethoxy)-1,2,3,4,4a,9a-hexahydro-fluo...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12OCCO
Show InChI InChI=1S/C22H34N2O4/c1-21(2,3)23-14-16(26)15-28-24-20-18-9-5-4-8-17(18)19-10-6-7-11-22(19,20)27-13-12-25/h4-5,8-9,16,19,23,25-26H,6-7,10-15H2,1-3H3/b24-20-
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n/an/a 3.10E+3n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017387
PNG
(9a-Hydroxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12O
Show InChI InChI=1S/C20H30N2O3/c1-19(2,3)21-12-14(23)13-25-22-18-16-9-5-4-8-15(16)17-10-6-7-11-20(17,18)24/h4-5,8-9,14,17,21,23-24H,6-7,10-13H2,1-3H3/b22-18-
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n/an/a 3.10E+3n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036839
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-ethyl...)
Show SMILES CCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-12-10-6-8(11)5-9-7(2)3/h6-9,11H,4-5H2,1-3H3/b10-6+
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n/an/a 3.31E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036838
PNG
(Acetaldehyde O-(3-tert-butylamino-2-hydroxy-propyl...)
Show SMILES C\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-11-13-7-8(12)6-10-9(2,3)4/h5,8,10,12H,6-7H2,1-4H3/b11-5+
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n/an/a 4.07E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036837
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-propy...)
Show SMILES CCCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-13-11-7-9(12)6-10-8(2)3/h7-10,12H,4-6H2,1-3H3/b11-7+
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n/an/a 4.37E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50041915
PNG
(1-(Isopropylamino-methyl)-isochroman-6,7-diol | CH...)
Show SMILES CC(C)NCC1OCCc2cc(O)c(O)cc12
Show InChI InChI=1S/C13H19NO3/c1-8(2)14-7-13-10-6-12(16)11(15)5-9(10)3-4-17-13/h5-6,8,13-16H,3-4,7H2,1-2H3
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n/an/a 5.50E+3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-2 adrenergic receptor in guinea pig tracheal strip is determined


J Med Chem 36: 3077-86 (1993)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017380
PNG
(9a-(2-Hydroxy-ethoxy)-5,6,7,8,9,9a-hexahydro-4bH-b...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12OCCO
Show InChI InChI=1S/C23H36N2O4/c1-22(2,3)24-15-17(27)16-29-25-21-19-10-7-6-9-18(19)20-11-5-4-8-12-23(20,21)28-14-13-26/h6-7,9-10,17,20,24,26-27H,4-5,8,11-16H2,1-3H3/b25-21-
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n/an/a 7.90E+3n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50017382
PNG
(13a-Methoxy-5,6,7,8,9,10,11,12,13,13a-decahydro-4b...)
Show SMILES COC12CCCCCCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C25H40N2O3/c1-19(2)26-17-20(28)18-30-27-24-22-14-11-10-13-21(22)23-15-9-7-5-4-6-8-12-16-25(23,24)29-3/h10-11,13-14,19-20,23,26,28H,4-9,12,15-18H2,1-3H3/b27-24-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig trachea(IT)


J Med Chem 32: 315-20 (1989)

More data for this
Ligand-Target Pair
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