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Cell Reactant:BDBM14834
Syringe Reactant:5-hydroxytryptamine receptor 2A
Meas. Tech.:Isothermal Titration Calorimetry
Entry Date:04/16/07
 
Δ G ° :n/a
pH:7±n/a
Log10Kb:7.70± n/a
Temperature:298.15±n/a (K)
ΔH° :n/a
ΔHobs :-47.7±0.836 (kJ/mole)
Ionic Strength:n/a
Corrected for ΔHioniz:no
Protons Released:n/a
ΔCp :n/a
Stoich. Param.:n/a
ΔS° :n/a
Comments:n/a
 
Citation Kroe, RRRegan, JProto, APeet, GWRoy, TLandro, LDFuschetto, NGPargellis, CAIngraham, RH Thermal denaturation: a method to rank slow binding, high-affinity P38alpha MAP kinase inhibitors. J Med Chem46:4669-75 (2003) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Data Fit Method ,  Instrument Info
 
BDBM14834
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM14834
Synonyms:1-[5-(2-Hydroxy-1,1-dimethylethyl)-2-p-tolyl-2H-pyrazol-3-yl]-3-[4-(2-morpholin-4-yl-ethoxy)-naphthalen-1-yl]-urea | 3-[3-(1-hydroxy-2-methylpropan-2-yl)-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea | BIRB-796 Analog 11 | CHEMBL107850 | Dopamine D2 receptor and serotonin 2a receptor | diaryl urea compound 3
TypeSmall organic molecule
Emp. Form.C31H37N5O4
Mol. Mass.543.6566
SMILESCc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)CO
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
5-hydroxytryptamine receptor 2A
Source:The full-length open reading frame of murine p38 alpha was cloned and expressed in E. coli.
Purity:n/a
Prep. Method:Soluble murine p38R was extracted from cell pellets and purified by using ion-exchange chromatography. Column fractions were concentrated, analyzed by SDS-PAGE, and pooled based on purity.
Name:5-hydroxytryptamine receptor 2A
Synonyms:5-HT-2 | 5-HT-2A | 5-HT2A | 5-hydroxytryptamine receptor 2A (5-HT-2A) | 5-hydroxytryptamine receptor 2A (5HT-2A) | 5-hydroxytryptamine receptor 2A (5HT2A) | 5HT2A_HUMAN | HTR2 | HTR2A | Serotonin receptor 2A
Type:undefined
Mol. Mass.:52607.65
Organism:Homo sapiens (Human)
Description:P28223
Residue:471
Sequence:
MDILCEENTSLSSTTNSLMQLNDDTRLYSNDFNSGEANTSDAFNWTVDSENRTNLSCEGC
LSPSCLSLLHLQEKNWSALLTAVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIAD
MLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTASIMHLCAISLDRYVAIQNP
IHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSF
VSFFIPLTIMVITYFLTIKSLQKEATLCVSDLGTRAKLASFSFLPQSSLSSEKLFQRSIH
REPGSYTGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNEDVIGA
LLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENKKPLQLILVNTIPALAYK
SSQLQMGQKKNSKQDAKTTDNDCSMVALGKQHSEEASKDNSDGVNEKVSCV
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