0 B9R1.12 c1csc(n1)NCCN EB11540 [0,0,0,0,0,0|3,1,0]=4 1 B10R1.11 CCOC(=N)c1cccs1 EB12158 [0,1,0,0,0,0|1,1,1]=4 2 B10R1.16 CCCCc1nc(sn1)Cl EB12808 [0,1,0,0,0,0|3,0,0]=4 3 B10R1.16 CCCCn1cc(cn1)N EB27042 [0,1,0,0,0,0|2,0,0]=3 4 B10R1.16 CCCCn1ccc(n1)N EB26042 [0,1,0,0,0,0|2,0,0]=3 5 B10R1.16 COCCn1cc(cn1)N EB27032 [0,1,0,0,0,0|3,0,0]=4 6 B10R1.16 COCCn1ccc(n1)N EB26032 [0,1,0,0,0,0|3,0,0]=4 7 B10R1.21 C=CCNCc1ccco1 EB16788 [0,1,0,0,0,0|0,0,2]=3 8 B10R1.21 C=CCNCc1ccco1 EB16789 [0,1,0,0,0,0|0,0,2]=3 9 B10R1.21 C=CCNCc1cccs1 EB16900 [0,1,0,0,0,0|0,1,2]=4 10 B10R1.21 C=CCNCc1cccs1 EB16901 [0,1,0,0,0,0|0,1,2]=4 11 B10R1.21 CCCNCc1ccco1 EB16486 [0,1,0,0,0,0|0,0,0]=1 12 B10R1.21 CCCNCc1ccco1 EB16487 [0,1,0,0,0,0|0,0,0]=1 13 B10R1.21 CCCNCc1cccs1 EB16598 [0,1,0,0,0,0|0,1,0]=2 14 B10R1.21 CCCNCc1cccs1 EB16599 [0,1,0,0,0,0|0,1,0]=2 15 B10R1.21 c1csc(n1)NCCCN EB11542 [0,1,0,0,0,0|2,1,0]=4 16 B10R1.66 CC(C)NCc1ccco1 EB16317 [0,1,0,0,0,0|1,0,0]=2 17 B10R1.66 CC(C)NCc1ccco1 EB16395 [0,1,0,0,0,0|1,0,0]=2 18 B10R1.66 CC(C)NCc1cccs1 EB16333 [0,1,0,0,0,0|1,1,0]=3 19 B10R1.66 CC(C)NCc1cccs1 EB16452 [0,1,0,0,0,0|1,1,0]=3 20 B10R1.66 CC(C)NCc1ccoc1 LUEB066 [0,1,0,0,0,0|3,0,0]=4 21 B8R0.1 CCCCC(=N)OCC EB12150 [0,0,1,0,0,0|1,0,2]=4 22 B10R1.17 c1ccnc(c1)NCCN EB11521 [0,0,0,0,0,1|3,0,0]=4 23 B10R1.17 c1cnccc1NCCN EB11511 [0,0,0,0,0,1|3,0,0]=4 24 B9R1.7 CCCn1cc(cn1)N EB27051 [1,1,0,0,0,0|2,0,0]=4 25 B9R1.7 CCCn1ccc(n1)N EB26051 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.11 CC(c1ccco1)NO EB60357 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.28 CCCNCc1ccccn1 EB16589 [0,1,0,0,0,1|1,0,0]=3 28 B11R1.28 CCCNCc1ccccn1 EB16590 [0,1,0,0,0,1|1,0,0]=3 29 B11R1.28 CCCNCc1ccccn1 EB16591 [0,1,0,0,0,1|1,0,0]=3 30 B11R1.28 CCCNCc1cccnc1 EB16592 [0,1,0,0,0,1|1,0,0]=3 31 B11R1.28 CCCNCc1cccnc1 EB16593 [0,1,0,0,0,1|1,0,0]=3 32 B11R1.28 CCCNCc1cccnc1 EB16594 [0,1,0,0,0,1|1,0,0]=3 33 B11R1.28 CCCNCc1ccncc1 EB16595 [0,1,0,0,0,1|1,0,0]=3 34 B11R1.28 CCCNCc1ccncc1 EB16596 [0,1,0,0,0,1|1,0,0]=3 35 B11R1.28 CCCNCc1ccncc1 EB16597 [0,1,0,0,0,1|1,0,0]=3 36 B11R1.28 c1ccnc(c1)NCCCN EB11522 [0,1,0,0,0,1|2,0,0]=4 37 B11R1.28 c1cnccc1NCCCN EB11512 [0,1,0,0,0,1|2,0,0]=4 38 B11R1.91 CC(C)NCc1ccccn1 EB16330 [0,1,0,0,0,1|2,0,0]=4 39 B11R1.91 CC(C)NCc1ccccn1 EB16449 [0,1,0,0,0,1|2,0,0]=4 40 B11R1.91 CC(C)NCc1ccccn1 EB16458 [0,1,0,0,0,1|2,0,0]=4 41 B11R1.91 CC(C)NCc1cccnc1 EB16331 [0,1,0,0,0,1|2,0,0]=4 42 B11R1.91 CC(C)NCc1cccnc1 EB16450 [0,1,0,0,0,1|2,0,0]=4 43 B11R1.91 CC(C)NCc1cccnc1 EB16459 [0,1,0,0,0,1|2,0,0]=4 44 B11R1.91 CC(C)NCc1ccncc1 EB16332 [0,1,0,0,0,1|2,0,0]=4 45 B11R1.91 CC(C)NCc1ccncc1 EB16451 [0,1,0,0,0,1|2,0,0]=4 46 B11R1.91 CC(C)NCc1ccncc1 EB16460 [0,1,0,0,0,1|2,0,0]=4 47 B11R1.15 CCCC(C)n1cc(cn1)N EB27084 [0,2,0,0,0,0|2,0,0]=4 48 B11R1.15 CCCC(C)n1ccc(n1)N EB26084 [0,2,0,0,0,0|2,0,0]=4 49 B11R1.27 CCCCCn1cc(cn1)N EB27040 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.27 CCCCCn1ccc(n1)N EB26040 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.27 CCCNCc1ccc(o1)C EB16532 [0,2,0,0,0,0|0,0,0]=2 52 B11R1.27 CCCNCc1ccc(o1)C EB16533 [0,2,0,0,0,0|0,0,0]=2 53 B11R1.27 CCOCCn1cc(cn1)N EB27027 [0,2,0,0,0,0|2,0,0]=4 54 B11R1.27 CCOCCn1ccc(n1)N EB26027 [0,2,0,0,0,0|2,0,0]=4 55 B11R1.27 Cc1ccc(o1)CNCC=C EB16834 [0,2,0,0,0,0|0,0,2]=4 56 B11R1.27 Cc1ccc(o1)CNCC=C EB16835 [0,2,0,0,0,0|0,0,2]=4 57 B11R1.75 CC(C)CCn1cc(cn1)N EB27050 [0,2,0,0,0,0|2,0,0]=4 58 B11R1.75 CC(C)CCn1ccc(n1)N EB26050 [0,2,0,0,0,0|2,0,0]=4 59 B11R1.75 Cc1ccc(o1)CNC(C)C EB16355 [0,2,0,0,0,0|1,0,0]=3 60 B11R1.75 Cc1ccc(o1)CNC(C)C EB16419 [0,2,0,0,0,0|1,0,0]=3 61 B11R1.4 CCCCNCc1ccco1 EB16637 [0,2,0,0,0,0|0,0,0]=2 62 B11R1.4 CCCCNCc1ccco1 EB16638 [0,2,0,0,0,0|0,0,0]=2 63 B11R1.4 CCCCNCc1cccs1 EB16749 [0,2,0,0,0,0|0,1,0]=3 64 B11R1.4 CCCCNCc1cccs1 EB16750 [0,2,0,0,0,0|0,1,0]=3 65 B11R1.4 CCCCNCc1ccoc1 LUEB067 [0,2,0,0,0,0|2,0,0]=4 66 B11R1.25 CCC(C)NCc1ccco1 EB16923 [0,2,0,0,0,0|0,0,0]=2 67 B11R1.25 CCC(C)NCc1ccco1 EB17003 [0,2,0,0,0,0|0,0,0]=2 68 B11R1.25 CCC(C)NCc1cccs1 EB16939 [0,2,0,0,0,0|0,1,0]=3 69 B11R1.25 CCC(C)NCc1cccs1 EB17058 [0,2,0,0,0,0|0,1,0]=3 70 B11R1.172 CC(C)CNCc1ccco1 EB17092 [0,2,0,0,0,0|0,0,0]=2 71 B11R1.172 CC(C)CNCc1ccco1 EB17093 [0,2,0,0,0,0|0,0,0]=2 72 B11R1.172 CC(C)CNCc1cccs1 EB17204 [0,2,0,0,0,0|0,1,0]=3 73 B11R1.172 CC(C)CNCc1cccs1 EB17205 [0,2,0,0,0,0|0,1,0]=3 74 B11R1.172 CC(C)CNCc1ccoc1 LUEB064 [0,2,0,0,0,0|2,0,0]=4 75 B11R1.180 CCCNCc1c(ccs1)C EB16522 [0,2,0,0,0,0|0,1,0]=3 76 B11R1.180 CCCNCc1c(ccs1)C EB16523 [0,2,0,0,0,0|0,1,0]=3 77 B11R1.180 CCCNCc1cccn1C EB16506 [0,2,0,0,0,0|1,0,0]=3 78 B11R1.180 CCCNCc1cccn1C EB16507 [0,2,0,0,0,0|1,0,0]=3 79 B11R1.90 CC(C)NCc1cccn1C EB16342 [0,2,0,0,0,0|2,0,0]=4 80 B11R1.90 CC(C)NCc1cccn1C EB16405 [0,2,0,0,0,0|2,0,0]=4 81 B11R1.90 Cc1ccsc1CNC(C)C EB16347 [0,2,0,0,0,0|1,1,0]=4 82 B11R1.90 Cc1ccsc1CNC(C)C EB16413 [0,2,0,0,0,0|1,1,0]=4 83 B9R1.8 C1CCC(=CC1)NC=O EB61600 [0,0,1,1,0,0|2,0,0]=4 84 B11R2.2 c1cc(oc1)C2CCCN2 EB60381 [0,1,0,1,0,0|0,0,0]=2 85 B11R2.2 c1cc(oc1)C2CCCN2 EB60502 [0,1,0,1,0,0|0,0,0]=2 86 B11R2.2 c1cc(sc1)C2CCCN2 EB60380 [0,1,0,1,0,0|0,1,0]=3 87 B11R2.106 CC1c2ccsc2CCN1 EB61741 [0,1,0,1,0,0|0,1,0]=3 88 B11R2.18 c1csc2c1CCNCC2 EB61747 [0,1,0,1,0,0|0,1,0]=3 89 B11R2.385 c1cocc1CNC2CC2 LUEB065 [0,1,0,1,0,0|2,0,0]=4