11224409 -OEChem-10051722443D 55 58 0 1 0 0 0 0 0999 V2000 0.2703 3.0009 0.0606 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3028 0.6295 -0.8962 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 2.4128 -0.6722 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 -2.8756 0.1023 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1134 0.1907 -0.5676 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1717 -0.8010 0.7784 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4318 0.1350 0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9673 -1.8806 0.6782 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6849 -2.5803 -0.2152 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8846 -2.0504 -1.4328 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2098 -0.7840 -0.6709 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7323 -1.0875 -0.7966 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7720 -1.1003 0.7081 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7138 0.3430 -0.3537 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 1.1988 -0.6941 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1593 1.6186 -0.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8974 -0.7833 -0.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0279 0.6418 0.0654 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7884 1.7679 -0.0387 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5265 -0.6338 -0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4511 0.7917 0.2823 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1945 1.0789 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1709 -1.7176 0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2293 1.4817 -0.6472 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0447 0.2454 1.4202 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6612 1.2322 0.9209 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6009 1.6253 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4163 0.3890 1.6287 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5529 -1.1364 0.6018 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8548 0.3267 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6737 -0.7881 -0.0325 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2311 -0.8913 -1.3147 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7806 -1.3051 -1.4479 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4846 -1.4055 -1.8158 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4135 -1.8511 -0.0814 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6212 -2.1581 0.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2858 -0.4951 1.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7331 2.5325 -0.3179 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2816 -1.7944 -0.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4388 0.1399 1.0536 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0933 -1.5247 0.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7879 1.9095 -1.5444 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4557 -0.2916 2.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8578 1.2993 1.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9877 2.1900 0.4947 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1964 2.1624 -1.1725 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8668 -0.0419 2.5189 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -0.7445 0.7593 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6399 -0.5684 1.5325 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2913 -1.9427 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7525 -0.4770 -0.2471 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0684 0.3881 1.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1862 1.2706 0.1109 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1969 -0.2042 -2.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0668 -3.4885 0.0238 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 11 1 0 0 0 0 2 15 1 0 0 0 0 3 15 2 0 0 0 0 4 23 2 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 13 1 0 0 0 0 6 23 1 0 0 0 0 6 40 1 0 0 0 0 7 26 1 0 0 0 0 7 30 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 31 2 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 10 32 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 16 19 1 0 0 0 0 16 38 1 0 0 0 0 17 20 2 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 41 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 23 29 1 0 0 0 0 24 27 1 0 0 0 0 24 42 1 0 0 0 0 25 28 2 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 54 1 0 0 0 0 M END > DB12339 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/BTTNOGHPGJANSW-IBGZPJMESA-N/SDF?record_type=3d > CC(=O)NC[C@H]1CN(C(=O)O1)C1=CC=C(C(F)=C1)C1=CC=C(CNCC2=CN=NN2)C=C1 > InChI=1S/C22H23FN6O3/c1-14(30)25-12-19-13-29(22(31)32-19)18-6-7-20(21(23)8-18)16-4-2-15(3-5-16)9-24-10-17-11-26-28-27-17/h2-8,11,19,24H,9-10,12-13H2,1H3,(H,25,30)(H,26,27,28)/t19-/m0/s1 > BTTNOGHPGJANSW-IBGZPJMESA-N > C22H23FN6O3 > 438.463 > 438.181566788 > 6 > 55 > 45.19410919145645 > 1 > 3 > 0 > 1 > N-{[(5S)-3-[2-fluoro-4'-({[(1H-1,2,3-triazol-5-yl)methyl]amino}methyl)-[1,1'-biphenyl]-4-yl]-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide > 1.23 > 1.2898434493371318 > -4.01 > 1 > 4 > 1 > 15.09396055127802 > 8.558030805171281 > 7.461293102680865 > 112.24000000000001 > 115.89040000000001 > 8 > 1 > 4.30e-02 g/l > radezolid > 0 $$$$