Name: ROR agonist-1
Rating: 5 (10 reviews)

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HIT ID:HIT212686798
Cas No:2361528-74-5
常用名:ROR agonist-1
IUPAC:(2R)-2-acetamido-2-[4-(ethanesulfonyl)phenyl]-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]acetamide
IUPAC:(2R)-2-acetamido-2-[4-(ethanesulfonyl)phenyl]-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]acetamide
InChI key:HJJYGXDBXQAVQG-QGZVFWFLSA-N

分子式:C21H20F6N2O5S
分子量:526.45
氢键供体数 (HBD):3
氢键受体数 (HBA):5
LogP:2.5177865
SMILES:CCS(=O)(=O)c1ccc(cc1)[C@@H](NC(C)=O)C(=O)Nc1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
SMILES:CCS(=O)(=O)c1ccc(cc1)[C@@H](NC(C)=O)C(=O)Nc1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F

ROR agonist-1 is a potent and orally bioavailable the retinoic acid receptor-related orphan receptor C2 (RORC2) inverse agonist(inhibition of IL-17A production from human primary TH 17 cells with a pIC50 of 7.5).

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