PDB CCD ID: | 2TF | ||||||||||||
Number of entries in BioLiP: | 2 | ||||||||||||
Chemical formula: | C21 H23 F3 N4 O4 S | ||||||||||||
InChI: | InChI=1S/C21H23F3N4O4S/c1-2-3-17-13-27(33(31,32)18-8-9-19(25)26-12-18)10-11-28(17)16-6-4-15(5-7-16)20(30,14-29)21(22,23)24/h4-9,12,17,29-30H,10-11,13-14H2,1H3,(H2,25,26)/t17-,20+/m0/s1 | ||||||||||||
InChIKey: | HZYIALCWDCIMRP-FXAWDEMLSA-N | ||||||||||||
SMILES: |
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Name: | (2S)-2-{4-[(2S)-4-[(6-aminopyridin-3-yl)sulfonyl]-2-(prop-1-yn-1-yl)piperazin-1-yl]phenyl}-3,3,3-trifluoropropane-1,2-diol | ||||||||||||
ChEMBL: | CHEMBL3237980 | ||||||||||||
ZINC: | ZINC000098208269 |