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Amb22370255

Duplicate ID
Molecule Name Baricitinib (LY3009104)
SmilesCCS(=O)(=O)N1CC(C1)(CC#N)[n]1cc(c[n]1)-c1[n]c[n]c2[nH]ccc21
Cas Number 1187594-09-7
InchiKeyXUZMWHLSFXCVMG-UHFFFAOYSA-N
InChi InChI=1S/C16H17N7O2S/c1-2-26(24,25)22-9-16(10-22,4-5-17)23-8-12(7-21-23)14-13-3-6-18-15(13)20-11-19-14/h3,6-8,11,18H,2,4,9-10H2,1H3
Formula C16H17N7O2S
Molecular weight 371.417
Rings 4
logP 2.11438
PSA 128.94
MR 98.5067
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