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Chemical structure of CAS 2097085-63-5

Htl-0022562

CAS No.2097085-63-5
MDL No.N/A
MFC40H49N11O5
MW763.90
InChI KeyLIPVCPUZWNTQHV-SAIUNTKASA-N

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Product Information

CAS No.2097085-63-5
Product NameHtl-0022562
Heavy Atom Count56Rotatable Bond Count9
Atom Stereo Count2Bond Stereo Count0
HBA10HBD5
TPSA189.810 ŲCharge0
Exact Mass763.39181Complexity2053.58
pKa5.875XLogP3.059

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Studies related to this compound and its mechanism of action

Structure-Based Drug Discovery of -(()-3-(7-Methyl-1-indazol-5-yl)-1-oxo-1-((()-1-oxo-3-(piperidin-4-yl)-1-(4-(pyridin-4-yl)piperazin-1-yl)propan-2-yl)amino)propan-2-yl)-2'-oxo-1',2'-dihydrospiro[piperidine-4,4'-pyrido[2,3-][1,3]oxazine]-1-carboxamide (HTL22562): A Calcitonin Gene-Related Peptide Receptor Antagonist for Acute Treatment of Migraine.

Journal of medicinal chemistry • Vol. 63, Issue 14 • 2020
PMID: 32558564DOI: 10.1021/acs.jmedchem.0c01003

Documentation

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