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BDBM50408824 CHEMBL347660

SMILES: CC(C)n1cc2C[C@@H]3[C@H](C[C@@H](COC(=O)C4CC4)CN3C)c3cccc1c23

InChI Key: InChIKey=WAFXAEGTAKCBCH-QFIXIFRTSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50408824   
Target/Host
(Institution)
LigandTarget/Host
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
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50408824
PNG
(CHEMBL347660)
Show SMILES CC(C)n1cc2C[C@@H]3[C@H](C[C@@H](COC(=O)C4CC4)CN3C)c3cccc1c23
Show InChI InChI=1S/C23H30N2O2/c1-14(2)25-12-17-10-21-19(18-5-4-6-20(25)22(17)18)9-15(11-24(21)3)13-27-23(26)16-7-8-16/h4-6,12,14-16,19,21H,7-11,13H2,1-3H3/t15-,19-,21-/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 6.03n/an/an/an/an/a



Freie Universit£t Berlin

Curated by ChEMBL


Assay Description
Effectiveness of compound in blocking 5-hydroxytryptamine 2A receptor-mediated contractions of rat tail artery


J Med Chem 42: 659-68 (1999)


Article DOI: 10.1021/jm981092u
BindingDB Entry DOI: 10.7270/Q21J9C0D
More data for this
Ligand-Target Pair