0 B15R1.8394 NC1=NC(=O)N(C=C1Br)CC(O)C(=O)O MCULE-6786202696 [0,0,0,0,0,0|2,0,1]=3 1 B15R1.8394 N[C@@H](CC1=CC(=O)C(=O)C=C1O)C(=O)O MCULE-4668012728 [0,0,0,0,0,0|3,0,1]=4 2 B15R1.8394 N[C@@H](CN1C=C(C(=O)NC1=O)F)C(=O)O MCULE-2424200917 [0,0,0,0,0,0|0,1,0]=1 3 B15R1.8394 N[C@@H](CN1C=C(C(=O)NC1=O)F)C(=O)O MCULE-4292777745 [0,0,0,0,0,0|0,1,0]=1 4 B15R1.8394 N[C@@H](CN1C=C(C(=O)NC1=O)F)C(=O)O MCULE-7037460200 [0,0,0,0,0,0|0,1,0]=1 5 B15R1.8394 N[C@@H](CN1C=C(C(=O)NC1=O)F)C(=O)O MCULE-7617415961 [0,0,0,0,0,0|0,1,0]=1 6 B15R1.8394 N[C@@H](CN1C=C(C(=O)NC1=O)I)C(=O)O MCULE-8831847676 [0,0,0,0,0,0|0,1,0]=1 7 B14R1.686 C(N)(CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-6953076060 [1,0,0,0,0,0|2,0,0]=3 8 B14R1.686 NC(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-3374977523 [1,0,0,0,0,0|2,0,1]=4 9 B14R1.686 NC(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-6181724347 [1,0,0,0,0,0|2,0,1]=4 10 B14R1.686 N[C@@H](CC1=CC=C(C(=C1)Br)F)C(=O)O MCULE-3066216517 [1,0,0,0,0,0|3,0,0]=4 11 B14R1.686 N[C@@H](CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-2538604003 [1,0,0,0,0,0|2,0,0]=3 12 B14R1.686 N[C@@H](CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-5494372638 [1,0,0,0,0,0|2,0,0]=3 13 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-3413267848 [1,0,0,0,0,0|2,0,1]=4 14 B14R1.686 N[C@H](CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-9740236562 [1,0,0,0,0,0|2,0,1]=4 15 B14R1.686 [C@@H](N)(CN1C=CC(=O)C(=C1)O)C(=O)O MCULE-2886907026 [1,0,0,0,0,0|2,0,0]=3 16 B14R1.686 [C@H](N)(CC1=CC(=C(C=C1)O)Br)C(=O)O MCULE-3725297150 [1,0,0,0,0,0|2,0,1]=4 17 B14R1.686 [C@H](N)(CC1=CC=C(C(=C1)Br)O)C(=O)O MCULE-8641777132 [1,0,0,0,0,0|2,0,1]=4 18 B14R1.4474 NC(CC1=C(C=CC(=C1)Br)Cl)C(=O)O MCULE-7201334917 [1,0,0,0,0,0|3,0,0]=4 19 B14R1.4474 NC(CC1=CC(=CC=C1F)Br)C(=O)O MCULE-5998109392 [1,0,0,0,0,0|3,0,0]=4 20 B14R1.4474 N[C@@H](CC1=CC(=CC=C1Cl)Br)C(=O)O MCULE-3349796329 [1,0,0,0,0,0|3,0,0]=4 21 B14R1.4474 N[C@@H](CC1=CC(=CC=C1Cl)Br)C(=O)O MCULE-8402340752 [1,0,0,0,0,0|3,0,0]=4 22 B14R1.6036 CC1=CN(C(=O)N=C1O)CCC(=O)O MCULE-7159849537 [1,0,0,0,0,0|1,0,2]=4 23 B14R1.6036 O=C(O)CCN1C=C(C(=O)NC1=O)Br MCULE-7686454057 [1,0,0,0,0,0|0,0,0]=1 24 B14R1.6036 O=C(O)CCN1C=C(C(=O)NC1=O)F MCULE-9006605987 [1,0,0,0,0,0|0,1,0]=2 25 B14R1.6036 O=C(O)CCN1C=C(C(=O)NC1=O)I MCULE-3394211422 [1,0,0,0,0,0|0,1,0]=2 26 B14R1.6049 NC(CN1C=CC(=O)NC1=O)C(=O)O MCULE-8038508098 [1,0,0,0,0,0|0,0,0]=1 27 B14R1.6049 N[C@@H](CN1C=CC(=O)NC1=O)C(=O)O MCULE-5181449514 [1,0,0,0,0,0|0,0,0]=1 28 B14R1.6049 N[C@@H](CN1C=CC(=O)NC1=O)C(=O)O MCULE-6544606181 [1,0,0,0,0,0|0,0,0]=1 29 B16R1.94253 COC(=O)C(N)CN1C=C(C(=O)NC1=O)C MCULE-7652467664 [0,1,0,0,0,0|1,0,0]=2 30 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-2348274001 [2,0,0,0,0,0|2,0,0]=4 31 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O MCULE-6147884206 [2,0,0,0,0,0|2,0,0]=4 32 B13R1.148 NC(CC1=CC=CC(=C1)Br)C(=O)O MCULE-8007269772 [2,0,0,0,0,0|2,0,0]=4 33 B13R1.148 N[C@@H](CC1=CC(=CC=C1)Br)C(=O)O MCULE-3495438482 [2,0,0,0,0,0|2,0,0]=4 34 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-1686064373 [2,0,0,0,0,0|2,0,0]=4 35 B13R1.148 N[C@@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-4183003026 [2,0,0,0,0,0|2,0,0]=4 36 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-6055691240 [2,0,0,0,0,0|2,0,0]=4 37 B13R1.148 N[C@H](CC1=CC=CC(=C1)Br)C(=O)O MCULE-8797288798 [2,0,0,0,0,0|2,0,0]=4 38 B13R1.893 O=C(O)CCN1C=C(C=CC1=O)Br MCULE-5818245090 [2,0,0,0,0,0|1,0,0]=3 39 B13R1.164 NC(=O)CCN1C=CC(=O)NC1=O MCULE-5085296903 [2,0,0,0,0,0|1,0,0]=3 40 B13R1.164 O=C(O)CCN1C=CC(=O)NC1=O MCULE-2498545168 [2,0,0,0,0,0|0,0,0]=2 41 B15R1.5521 COC(=O)[C@@H](N)CN1C=CC(=O)C(=C1)O MCULE-5739020028 [1,1,0,0,0,0|2,0,0]=4 42 B15R1.1803 N#CC1=CN(C(=O)NC1=O)CCC(=O)O MCULE-7946913318 [1,1,0,0,0,0|1,0,0]=3 43 B15R1.1802 CC(C(=O)O)N1C=C(C(=O)NC1=O)C#N MCULE-4867797053 [0,1,0,0,1,0|2,0,0]=4 44 B17R1.96261 CN(C)[C@@H](CN1C=C(C(=O)NC1=O)Cl)C(=O)O MCULE-3707489129 [0,2,0,0,0,0|0,1,0]=3 45 B13R1.3481 NC(CN1OC(=O)NC1=O)C(=O)O MCULE-8805062077 [1,0,0,0,1,0|2,0,0]=4 46 B13R1.3481 N[C@@H](CN1OC(=O)NC1=O)C(=O)O MCULE-3085799912 [1,0,0,0,1,0|2,0,0]=4 47 B13R1.3481 N[C@@H](CN1OC(=O)NC1=O)C(=O)O MCULE-3186408705 [1,0,0,0,1,0|2,0,0]=4