0 B14R1.3331 CS(=O)(=O)NCCNC1CCCCC1 CSC011235628 [0,0,0,0,0,0|2,0,0]=2 1 B14R1.3331 CS(=O)(=O)NCCNC1CCSCC1 CSC011306121 [0,0,0,0,0,0|3,0,0]=3 2 B14R1.3331 CS(=O)(=O)NCCSC1CCCCC1 CSC031441670 [0,0,0,0,0,0|3,0,0]=3 3 B14R1.3331 CS(=O)(=O)NCCSC1CCCOC1 CSC037682518 [0,0,0,0,0,0|4,0,0]=4 4 B14R1.3331 NS(=O)(=O)CCCSC1CCCOC1 CSC056402983 [0,0,0,0,0,0|3,0,0]=3 5 B15R1.315 CCS(=O)(=O)NCCSC1CCCCC1 CSC036489473 [0,1,0,0,0,0|3,0,0]=4 6 B15R1.315 CNS(=O)(=O)CCNCC1CCCCC1 CSC013872814 [0,1,0,0,0,0|3,0,0]=4 7 B15R1.909 CC1CCC(CC1)NCCNS(=O)(=O)C CSC011235593 [0,1,0,0,0,0|2,0,0]=3 8 B15R1.8300 CC1CCCC(C1)NCCNS(=O)(=O)C CSC011235600 [0,1,0,0,0,0|2,0,0]=3 9 B15R1.9094 CN(CCNS(=O)(=O)C)C1CCNCC1 CSC057338083 [0,1,0,0,0,0|3,0,0]=4 10 B15R1.9094 CS(=O)(=O)CCCC(=O)N1CCCCC1 CSC038002809 [0,1,0,0,0,0|3,0,0]=4 11 B15R1.9094 NS(=O)(=O)CCCS(=O)C1CCCCC1 CSC030488141 [0,1,0,0,0,0|2,0,0]=3 12 B15R1.9094 NS(=O)(=O)CCNC(=O)C1CCCCC1 CSC011408920 [0,1,0,0,0,0|3,0,0]=4 13 B15R1.9108 CS(=O)(=O)CCC(=O)NC1CCCCC1 CSC011233795 [0,1,0,0,0,0|1,0,1]=3 14 B15R2.2225 CS(=O)(=O)N1CCCC12CCCCC2 CSC047895995 [0,0,0,1,0,0|3,0,0]=4 15 B15R2.4444 CS(=O)(=O)NC1CC1C2CCCCC2 CSC046196245 [0,0,0,1,0,0|3,0,0]=4 16 B15R2.4444 CS(=O)(=O)N[C@@H]1C[C@H]1C2CCCCC2 CSC032106433 [0,0,0,1,0,0|3,0,0]=4 17 B15R2.7532 O=S1(=O)CCC(C1)CN2CCCCC2 CSC028454533 [0,0,0,1,0,0|3,0,0]=4 18 B15R2.109477 CS(=O)(=O)N1CCSC2C1CCCC2 CSC047863106 [0,0,0,1,0,0|3,0,0]=4 19 B13R1.2904 CS(=O)(=O)NCCNC1CCCC1 CSC011235595 [0,0,0,0,1,0|2,0,0]=3 20 B13R1.2904 CS(=O)(=O)NCCSC1CCCC1 CSC020159036 [0,0,0,0,1,0|3,0,0]=4 21 B13R1.3523 CS(=O)(=O)NCCC1CCCCC1 CSC011255690 [0,0,0,0,1,0|2,0,0]=3 22 B13R1.3523 CS(=O)(=O)NCCC1CCNCC1 CSC011370078 [0,0,0,0,1,0|3,0,0]=4 23 B15R1.3890 CS(=O)(=O)NCCCNC1CCCCC1 CSC011228007 [0,0,0,0,0,1|1,0,0]=2 24 B15R1.3890 CS(=O)(=O)NCCCNC1CCOCC1 CSC012453119 [0,0,0,0,0,1|2,0,0]=3 25 B15R1.3890 CS(=O)(=O)NCCCNC1CCSCC1 CSC011228009 [0,0,0,0,0,1|2,0,0]=3 26 B15R1.3890 CS(=O)(=O)NCCCOC1CCCCO1 CSC028771074 [0,0,0,0,0,1|3,0,0]=4 27 B15R1.3890 CS(=O)(=O)NCCNCC1CCCCC1 CSC011235610 [0,0,0,0,0,1|2,0,0]=3 28 B15R1.3890 CS(=O)(=O)NCCSCC1CCCCC1 CSC026033029 [0,0,0,0,0,1|3,0,0]=4 29 B15R1.3890 NS(=O)(=O)CCCSCC1CCCCC1 CSC061437352 [0,0,0,0,0,1|2,0,0]=3 30 B15R1.16600 CS(=O)(=O)NCCNC1CCCCCC1 CSC011235594 [0,0,0,0,0,1|2,0,0]=3 31 B15R1.16600 NS(=O)(=O)NCCOC1CCCCCC1 CSC059990142 [0,0,0,0,0,1|3,0,0]=4 32 B12R1.8 OCCCCNC1CCCCC1 CSC000186385 [2,0,0,0,0,0|1,0,0]=3 33 B14R1.423 OC(=O)CCC(=O)NC1CCCCC1 CSC000186314 [1,1,0,0,0,0|1,0,1]=4 34 B14R1.330 CC1CCCC1NCCCS(=O)(=O)C CSC011836944 [0,1,0,0,1,0|1,0,0]=3 35 B14R1.330 CC1CCCC1NCCNS(=O)(=O)C CSC012205409 [0,1,0,0,1,0|2,0,0]=4 36 B14R1.6458 NS(=O)(=O)CCCS(=O)C1CCCC1 CSC052711184 [0,1,0,0,1,0|2,0,0]=4 37 B14R1.6470 CS(=O)(=O)CCC(=O)NC1CCCC1 CSC011272798 [0,1,0,0,1,0|1,0,1]=4 38 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)O CSC011823434 [0,1,0,0,1,0|2,0,0]=4 39 B14R1.242 CC1CCCCC1CCNS(=O)(=O)C CSC047490373 [0,1,0,0,1,0|2,0,0]=4 40 B14R1.242 CC1CCCCC1CCNS(=O)(=O)N CSC047896046 [0,1,0,0,1,0|2,0,0]=4 41 B14R1.292 CNS(=O)(=O)CCNC1CCCCC1 CSC013872806 [0,1,0,0,1,0|1,0,0]=3 42 B14R1.433 CS(=O)(=O)CC(=O)NC1CCCCC1 CSC000239387 [0,1,0,0,1,0|1,0,1]=4 43 B14R1.433 C[C@@H](CC1CCCCC1)NS(=O)(=O)C CSC047665080 [0,1,0,0,1,0|2,0,0]=4 44 B14R1.433 C[C@@H](CC1CCCCC1)NS(=O)(=O)N CSC042624938 [0,1,0,0,1,0|2,0,0]=4 45 B14R1.433 C[C@H](CC1CCCCC1)NS(=O)(=O)C CSC029205852 [0,1,0,0,1,0|2,0,0]=4 46 B14R1.433 C[C@H](CC1CCCCC1)NS(=O)(=O)N CSC047526479 [0,1,0,0,1,0|2,0,0]=4 47 B14R1.3099 CN(CCC1CCCCC1)S(=O)(=O)C CSC046144000 [0,1,0,0,1,0|2,0,0]=4 48 B14R1.3099 CN(CCC1CCCCC1)S(=O)(=O)N CSC046769922 [0,1,0,0,1,0|2,0,0]=4 49 B16R1.1083 CN1CCC(CC1)NCCCNS(=O)(=O)C CSC006161306 [0,1,0,0,0,1|2,0,0]=4 50 B16R1.8819 CC1CCCCC1NCCCNS(=O)(=O)C CSC000301165 [0,1,0,0,0,1|1,0,0]=3 51 B16R1.11256 CC1CCCC(C1)NCCCNS(=O)(=O)C CSC000301166 [0,1,0,0,0,1|1,0,0]=3 52 B16R1.12545 CS(=O)(=O)CCCNC(=O)C1CCCCC1 CSC061738875 [0,1,0,0,0,1|1,0,0]=3 53 B16R1.12545 CS(=O)(=O)CCCNC(=O)C1CCCCO1 CSC060642159 [0,1,0,0,0,1|2,0,0]=4 54 B16R1.12545 CS(=O)(=O)CCCNC(=O)C1CCCCS1 CSC061187405 [0,1,0,0,0,1|2,0,0]=4 55 B16R1.12545 CS(=O)(=O)CCCNC(=O)C1CCSCC1 CSC060682232 [0,1,0,0,0,1|2,0,0]=4 56 B16R1.12545 CS(=O)(=O)NCCNC(=O)C1CCCCC1 CSC046287262 [0,1,0,0,0,1|2,0,0]=4 57 B16R1.22556 CS(=O)(=O)CCC(=O)NCC1CCCCC1 CSC061103049 [0,1,0,0,0,1|1,0,1]=4 58 B16R1.59031 NS(=O)(=O)CCCS(=O)CC1CCCCC1 CSC061333491 [0,1,0,0,0,1|2,0,0]=4 59 B16R1.10438 CCS(=O)(=O)NCCNC1CCCCCC1 CSC005580864 [0,1,0,0,0,1|2,0,0]=4 60 B16R1.151143 CS(=O)(=O)CCC(=O)NC1CCCCCC1 CSC028663677 [0,1,0,0,0,1|1,0,1]=4 61 B16R1.329 CNS(=O)(=O)CCCNC1CCCCC1C CSC020289496 [0,2,0,0,0,0|1,0,0]=3 62 B16R1.12253 CN(C)S(=O)(=O)NCCNC1CCCCC1 CSC017380468 [0,2,0,0,0,0|2,0,0]=4 63 B16R1.1366 CCC1CCCCC1NCCNS(=O)(=O)C CSC005796513 [0,2,0,0,0,0|2,0,0]=4 64 B16R1.7424 CC1CCCCC1NC(=O)CCS(=O)(=O)C CSC053137907 [0,2,0,0,0,0|1,0,1]=4 65 B16R1.11231 CC1CCCC(C1NCCNS(=O)(=O)C)C CSC000306292 [0,2,0,0,0,0|2,0,0]=4 66 B16R1.45585 CC1(CCCCC1NCCNS(=O)(=O)C)C CSC006179030 [0,2,0,0,0,0|2,0,0]=4 67 B16R1.195 CCC1CCC(CC1)NCCNS(=O)(=O)C CSC000306290 [0,2,0,0,0,0|2,0,0]=4 68 B16R1.195 COC1CCC(CC1)NCCCS(=O)(=O)C CSC006626510 [0,2,0,0,0,0|1,0,0]=3 69 B16R1.1030 CC1CCC(CC1C)NCCNS(=O)(=O)C CSC005899861 [0,2,0,0,0,0|2,0,0]=4 70 B16R1.6849 CC1CC(CC(C1)NCCNS(=O)(=O)C)C CSC005898812 [0,2,0,0,0,0|2,0,0]=4 71 B16R1.45592 CC1(CC(CCO1)NCCCS(=O)(=O)C)C CSC005825067 [0,2,0,0,0,0|2,0,0]=4 72 B16R1.616 CN(C1CCCCC1)C(=O)CCS(=O)(=O)C CSC038541147 [0,2,0,0,0,0|1,0,1]=4 73 B14R1.2487 CCCCC(C)NC1CCS(=O)(=O)C1 CSC011340019 [0,0,1,1,0,0|1,0,0]=3 74 B14R1.16843 CC(NCCNS(=O)(=O)C)C1CCC1 CSC018801902 [0,0,1,1,0,0|2,0,0]=4 75 B14R1.3131 CS(=O)(=O)CCCN1CCCC1CO CSC011823446 [0,0,1,1,0,0|2,0,0]=4 76 B16R2.2313 CS(=O)(=O)N1CCCC1C2CCCCC2 CSC011408222 [0,0,0,1,0,1|2,0,0]=4 77 B16R2.6702 NS(=O)(=O)NC[C@@H]1C[C@H]1C2CCCCC2 CSC048351522 [0,0,0,1,0,1|2,0,0]=4 78 B16R2.12599 O=S1(=O)CCC(C1)CNC2CCCCC2 CSC011228021 [0,0,0,1,0,1|1,0,0]=3 79 B16R2.12599 O=S1(=O)CCC(C1)CSC2CCCCC2 CSC038439356 [0,0,0,1,0,1|2,0,0]=4 80 B16R2.12599 O=S1(=O)CCC(C1)NCC2CCCCC2 CSC000200283 [0,0,0,1,0,1|1,0,0]=3 81 B16R2.14817 O=S1(=O)CCCC(C1)NC2CCCCC2 CSC011948714 [0,0,0,1,0,1|1,0,0]=3 82 B16R2.14817 O=S1(=O)CCCC(C1)NC2CCCOC2 CSC011948835 [0,0,0,1,0,1|2,0,0]=4 83 B16R2.14817 O=S1(=O)CCCC(C1)NC2CCCSC2 CSC011949005 [0,0,0,1,0,1|2,0,0]=4 84 B16R2.14817 O=S1(=O)CCCC(C1)NC2CCSCC2 CSC011948981 [0,0,0,1,0,1|2,0,0]=4 85 B16R2.96850 O=S1(=O)CCC(C1)NC2CCCCCC2 CSC000200268 [0,0,0,1,0,1|1,0,0]=3 86 B16R2.322268 CS(=O)(=O)NCCN1C2CCC1CCC2 CSC048936418 [0,0,0,1,0,1|2,0,0]=4 87 B16R2.322276 CS(=O)(=O)NCCNC1CC2CCC1C2 CSC011451292 [0,1,0,1,0,0|2,0,0]=4 88 B16R2.33084 CC1CCC(CC1)NC2CCS(=O)(=O)C2 CSC000200267 [0,1,0,1,0,0|1,0,0]=3 89 B12R1.252 NC(=O)CCCC1CCCCC1 CSC000162275 [1,0,0,0,1,0|2,0,0]=4 90 B16R1.4470 CS(=O)(=O)NCCCNCC1CCCCC1 CSC000301159 [0,0,0,0,0,2|1,0,0]=3 91 B16R1.25863 CS(=O)(=O)NCCCNC1CCCCCC1 CSC000301164 [0,0,0,0,0,2|1,0,0]=3 92 B16R1.25863 CS(=O)(=O)NCCNCC1CCCCCC1 CSC006021229 [0,0,0,0,0,2|2,0,0]=4