LX-1031 ,945976-76-1 _Chemical Cloud Database

LX-1031

Basic Information
Product Name：	LX-1031
CAS：	945976-76-1
English Synonyms：	LX-1031 ; 4-[2-AMINO-6-[(1R)-2,2,2-TRIFLUORO-1-(3'-METHOXY[1,1'-BIPHENYL]-4-YL)ETHOXY]-4-PYRIMIDINYL]-L-PHENYLALANINE ; (S)-2-AMINO-3-(4-(2-AMINO-6-((R)-2,2,2-TRIFLUORO-1-(3'-METHOXY-[1,1'-BIPHENYL]-4-YL)ETHOXY)PYRIMIDIN-4-YL)PHENYL)PROPANOIC ACID
MDL Number.：	MFCD19443125
H bond acceptor：	8
H bond donor：	3
Smile：	COc1cccc(c1)c2ccc(cc2)[C@H](C(F)(F)F)Oc3cc(nc(n3)N)c4ccc(cc4)C[C@@H](C(=O)O)N
InChi：	InChI=1S/C28H25F3N4O4/c1-38-21-4-2-3-20(14-21)17-9-11-19(12-10-17)25(28(29,30)31)39-24-15-23(34-27(33)35-24)18-7-5-16(6-8-18)13-22(32)26(36)37/h2-12,14-15,22,25H,13,32H2,1H3,(H,36,37)(H2,33,34,35)/t22-,25+/m0/s1
InChiKey：	InChIKey=XNMUICFMGGQSMZ-WIOPSUGQSA-N
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