Name: RAF mutant-IN-1
Rating: 5 (10 reviews)

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HIT ID:HIT212686727
Cas No:2340020-82-6
常用名:RAF mutant-IN-1
IUPAC:4-amino-N-{1-[(3-chloro-2-fluoro-4-hydroxyphenyl)amino]-6-methylisoquinolin-5-yl}thieno[3,2-d]pyrimidine-7-carboxamide dihydrochloride
IUPAC:4-amino-N-{1-[(3-chloro-2-fluoro-4-hydroxyphenyl)amino]-6-methylisoquinolin-5-yl}thieno[3,2-d]pyrimidine-7-carboxamide dihydrochloride
InChI key:LUOSZUYSWJVQGN-UHFFFAOYSA-N

分子式:C23H18Cl3FN6O2S
分子量:567.85
氢键供体数 (HBD):4
氢键受体数 (HBA):7
LogP:4.931817
SMILES:Cl.Cl.Cc1ccc2c(Nc3ccc(O)c(Cl)c3F)nccc2c1NC(=O)c1csc2c(N)ncnc12
SMILES:Cl.Cl.Cc1ccc2c(Nc3ccc(O)c(Cl)c3F)nccc2c1NC(=O)c1csc2c(N)ncnc12

RAF mutant-IN-1 is an inhibitor of RAF kinase(IC50 values of 21 nM, 30 nM and 392 nM for C-RAF 340D/Y341D, B-RAFV600E and B-RAFWT, respectively).

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