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Chemical structure of MK-7246

GC19395

MK-7246

Also known as 2-[(7R)-7-[(4-fluorophenyl)sulfonyl-methylamino]-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetic acid

MK-7246 is a potent and selective CRTH2 antagonist with a Ki of 2·5±0·5 nM

ChemicalCAS1218918-62-7MW416.47FormulaC21H21FN2O4S
CAS number
1218918-62-7
Molecular weight
416.47
Formula
C21H21FN2O4S
Solubility
DMSO ： ≥ 250 mg/mL (600·28 mM)
InChIKey
JTCAGRAKUAAYDY-OAHLLOKOSA-N
Catalogue number
GC19395
Brand
GLPBIO
Computed properties PubChem CID 45268455 · XLogP 2.8 · TPSA 88 Ų · H-bond donors 1
XLogP
2.8
TPSA
88 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
29

SMILES CN([C@@H]1CCC2=C(C3=CC=CC=C3N2C1)CC(=O)O)S(=O)(=O)C4=CC=C(C=C4)F

Computed descriptors from PubChem (CID 45268455), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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