0 B19R3.19255 C(CC1CCCCC1)c2[n]c3[n]cccc3o2 Amb18621195 [0,0,0,0,0,0|3,1,0]=4 1 B19R3.19255 C(CC1CCCCC1)c2[n]c3ccc[n]c3o2 Amb18621299 [0,0,0,0,0,0|3,1,0]=4 2 B19R3.19255 C(NC1CCSCC1)c2cc3ccccc3o2 Amb23917474 [0,0,0,0,0,0|3,1,0]=4 3 B19R3.19255 C(NC1CNCCC1)c2[n]c3ccccc3[s]2 Amb23932131 [0,0,0,0,0,0|2,0,0]=2 4 B19R3.19255 C(NC1CSCCC1)c2[nH]c3ccccc3[n]2 Amb23959244 [0,0,0,0,0,0|3,0,0]=3 5 B19R3.19255 C(Nc1[nH]c2ccccc2[n]1)C3CCCCC3 Amb23912181 [0,0,0,0,0,0|3,0,0]=3 6 B19R3.19255 C(Nc1[nH]c2ccccc2[n]1)C3CCCCN3 Amb22272051 [0,0,0,0,0,0|4,0,0]=4 7 B19R3.19255 C(Nc1[n]c2ccccc2[s]1)C3CCCCN3 Amb22272057 [0,0,0,0,0,0|3,0,0]=3 8 B19R3.19255 C(Nc1[n]c2ccccc2o1)C3CCCCN3 Amb22274206 [0,0,0,0,0,0|3,1,0]=4 9 B19R3.19255 C(Nc1[n]c2ccccc2o1)C3CCNCC3 Amb22272056 [0,0,0,0,0,0|3,1,0]=4 10 B19R3.19255 C(OC1CCNCC1)c2[n]c3ccc[n]c3[s]2 Amb24001870 [0,0,0,0,0,0|4,0,0]=4 11 B19R3.19255 C(Oc1[nH]c2ccccc2[n]1)C3CCCCN3 Amb22272154 [0,0,0,0,0,0|3,1,0]=4 12 B19R3.19255 C(Oc1[nH]c2ccccc2[n]1)C3CCNCC3 Amb22272157 [0,0,0,0,0,0|3,1,0]=4 13 B19R3.19255 C(Oc1[n]c2ccccc2[s]1)C3CCCCN3 Amb22272162 [0,0,0,0,0,0|2,1,0]=3 14 B19R3.19255 C(Oc1[n]c2ccccc2[s]1)C3CCNCC3 Amb22272165 [0,0,0,0,0,0|2,1,0]=3 15 B19R3.19255 C(Oc1[n]c2ccccc2o1)C3CCCCN3 Amb22272158 [0,0,0,0,0,0|2,2,0]=4 16 B19R3.19255 C(Oc1[n]c2ccccc2o1)C3CCNCC3 Amb22272161 [0,0,0,0,0,0|2,2,0]=4 17 B19R3.19255 C(Oc1[n]c2ccccc2o1)C3CNCCC3 Amb22272160 [0,0,0,0,0,0|2,2,0]=4 18 B19R3.19255 C(Sc1[nH]c2ccccc2[n]1)C3CCCCN3 Amb22272237 [0,0,0,0,0,0|3,0,0]=3 19 B19R3.19255 C(Sc1[nH]c2ccccc2[n]1)C3CCCCN3 Amb22395635 [0,0,0,0,0,0|3,0,0]=3 20 B19R3.19255 C(Sc1[nH]c2ccccc2[n]1)C3CCNCC3 Amb21984769 [0,0,0,0,0,0|3,0,0]=3 21 B19R3.19255 C(Sc1[nH]c2ccccc2[n]1)C3CCNCC3 Amb22395599 [0,0,0,0,0,0|3,0,0]=3 22 B19R3.19255 C(Sc1[nH]c2ccccc2[n]1)N3CCOCC3 Amb19869787 [0,0,0,0,0,0|4,0,0]=4 23 B19R3.19255 C(Sc1[n]c2ccccc2[s]1)C3CCCCN3 Amb22272244 [0,0,0,0,0,0|2,0,0]=2 24 B19R3.19255 C(Sc1[n]c2ccccc2[s]1)C3CCCCN3 Amb22395627 [0,0,0,0,0,0|2,0,0]=2 25 B19R3.19255 C(Sc1[n]c2ccccc2[s]1)C3CCNCC3 Amb21984766 [0,0,0,0,0,0|2,0,0]=2 26 B19R3.19255 C(Sc1[n]c2ccccc2[s]1)C3CCNCC3 Amb22395590 [0,0,0,0,0,0|2,0,0]=2 27 B19R3.19255 C(Sc1[n]c2ccccc2[s]1)C3CNCCC3 Amb21984754 [0,0,0,0,0,0|2,0,0]=2 28 B19R3.19255 C(Sc1[n]c2ccccc2[s]1)C3CNCCC3 Amb22395606 [0,0,0,0,0,0|2,0,0]=2 29 B19R3.19255 C(Sc1[n]c2ccccc2o1)C3CCCCN3 Amb22272241 [0,0,0,0,0,0|2,1,0]=3 30 B19R3.19255 C(Sc1[n]c2ccccc2o1)C3CCCCN3 Amb22395630 [0,0,0,0,0,0|2,1,0]=3 31 B19R3.19255 C(Sc1[n]c2ccccc2o1)C3CCNCC3 Amb21984767 [0,0,0,0,0,0|2,1,0]=3 32 B19R3.19255 C(Sc1[n]c2ccccc2o1)C3CCNCC3 Amb22395594 [0,0,0,0,0,0|2,1,0]=3 33 B19R3.19255 C(Sc1cc2ccccc2[nH]1)C3CCCCN3 Amb24042276 [0,0,0,0,0,0|3,0,1]=4 34 B19R3.19255 C(Sc1cc2ccccc2[nH]1)C3CCNCC3 Amb24042277 [0,0,0,0,0,0|3,0,1]=4 35 B19R3.19255 C1CCC(=CSc2nc3c(s2)cccc3)CC1 Amb10554823 [0,0,0,0,0,0|1,0,1]=2 36 B19R3.19255 C1CCC(=NNc2nc3c([nH]2)cccc3)CC1 Amb1096634 [0,0,0,0,0,0|2,0,2]=4 37 B19R3.19255 C1CCC(=NNc2nc3c(s2)cccc3)CC1 Amb1153393 [0,0,0,0,0,0|1,0,2]=3 38 B19R3.19255 C1CCC(CN1)CNc2nc3c([nH]2)cccc3 Amb10598618 [0,0,0,0,0,0|4,0,0]=4 39 B19R3.19255 C1CCC(CN1)CNc2nc3c(s2)cccc3 Amb10598638 [0,0,0,0,0,0|3,0,0]=3 40 B19R3.19255 C1CCC(CN1)COc2nc3c([nH]2)cccc3 Amb10598623 [0,0,0,0,0,0|3,1,0]=4 41 B19R3.19255 C1CCC(CN1)COc2nc3c(s2)cccc3 Amb10598634 [0,0,0,0,0,0|2,1,0]=3 42 B19R3.19255 C1CCC(CO1)CNc2nc3c(o2)cccc3 Amb11440944 [0,0,0,0,0,0|3,1,0]=4 43 B19R3.19255 C1CCC(OC1)CSc2nc3c([nH]2)cccc3 Amb2278681 [0,0,0,0,0,0|3,0,0]=3 44 B19R3.19255 C1CN(CCO1)SSc2[n]c3ccccc3[s]2 Amb22733252 [0,0,0,0,0,0|3,0,0]=3 45 B19R3.19255 C1NCCCC1CNc2[nH]c3ccccc3[n]2 Amb22032898 [0,0,0,0,0,0|4,0,0]=4 46 B19R3.19255 C1NCCCC1CNc2[n]c3ccccc3o2 Amb21859677 [0,0,0,0,0,0|3,1,0]=4 47 B19R3.19255 C1NCCCC1CNc2[n]c3ccccc3o2 Amb22274208 [0,0,0,0,0,0|3,1,0]=4 48 B19R3.19255 C1NCCCC1CSc2[nH]c3ccccc3[n]2 Amb21984756 [0,0,0,0,0,0|3,0,0]=3 49 B19R3.19255 C1NCCCC1CSc2[nH]c3ccccc3[n]2 Amb22395614 [0,0,0,0,0,0|3,0,0]=3 50 B19R3.19255 C1NCCCC1CSc2[n]c3ccccc3o2 Amb21984755 [0,0,0,0,0,0|2,1,0]=3 51 B19R3.19255 C1NCCCC1CSc2[n]c3ccccc3o2 Amb22395609 [0,0,0,0,0,0|2,1,0]=3 52 B19R3.19255 C1NCCOC1CSc2[n]c3ccccc3o2 Amb23988541 [0,0,0,0,0,0|3,1,0]=4 53 B19R3.19255 C1SCCSC1CNc2[n]c3ccccc3[s]2 Amb23717564 [0,0,0,0,0,0|4,0,0]=4 54 B19R3.19255 N1CCC(CC1)CNc2nc3c([nH]2)cccc3 Amb10598617 [0,0,0,0,0,0|4,0,0]=4 55 B19R3.19255 N1CCC(CC1)CNc2nc3c(s2)cccc3 Amb10598637 [0,0,0,0,0,0|3,0,0]=3 56 B20R3.277 Clc1c2ccccc2[s]c1CNC3CCCCC3 Amb23912225 [0,1,0,0,0,0|2,0,0]=3 57 B20R3.277 Cn1c(CNC2CCCCC2)nc3c1cccc3 Amb1540721 [0,1,0,0,0,0|2,0,0]=3 58 B20R3.277 O=C1\C(=C\NN2CCCCC2)\Sc3c1cccc3 Amb1148079 [0,1,0,0,0,0|3,0,0]=4 59 B20R3.16119 CN(C1CCCCC1)Cc2nc3c(s2)cccc3 Amb10671445 [0,1,0,0,0,0|1,0,0]=2 60 B20R3.16119 CN(Cc1[nH]c2ccccc2[n]1)C3CCCCC3 Amb18620117 [0,1,0,0,0,0|2,0,0]=3 61 B20R3.16119 CN(Cc1[nH]c2ccccc2[n]1)C3CCNCC3 Amb19285671 [0,1,0,0,0,0|3,0,0]=4 62 B20R3.16119 CN(Cc1[n]c2ccccc2[s]1)C3CCNCC3 Amb23450109 [0,1,0,0,0,0|2,0,0]=3 63 B20R3.16119 O=C(C1CCOCC1)Nc2nc3c(s2)cccc3 Amb15888247 [0,1,0,0,0,0|3,0,0]=4 64 B20R3.16119 O=C(Nc1[n]c2ccccc2[s]1)[C@@H]3CCCCN3 Amb25414156 [0,1,0,0,0,0|3,0,0]=4 65 B20R3.16119 O=C(Nc1[n]c2ccccc2[s]1)[C@H]3CCCCN3 Amb25414155 [0,1,0,0,0,0|3,0,0]=4 66 B20R3.91525 CC1CC(CCC1)NCc2[nH]c3ccccc3[n]2 Amb23912277 [0,1,0,0,0,0|2,0,0]=3 67 B20R3.91525 OC1CC(CNc2[nH]c3ccccc3[n]2)CCC1 Amb23775565 [0,1,0,0,0,0|3,0,0]=4 68 B20R3.94169 Cc1cc2[nH]c(CCC3CCCCC3)[n]c2cc1 Amb23967638 [0,1,0,0,0,0|3,0,0]=4 69 B20R3.94169 Cc1cc2[n]c(CNC3CCCCC3)[nH]c2cc1 Amb19664078 [0,1,0,0,0,0|2,0,0]=3 70 B20R3.94169 Cc1cc2[n]c(CNN3CCCCC3)[nH]c2cc1 Amb19664108 [0,1,0,0,0,0|3,0,0]=4 71 B20R3.94169 Cc1cc2[n]c([nH]c2cc1)SCC3CNCCC3 Amb23956533 [0,1,0,0,0,0|3,0,0]=4 72 B20R3.94169 Cc1cc2[s]c(NCC3CCCCC3)[n]c2cc1 Amb24078085 [0,1,0,0,0,0|2,0,0]=3 73 B20R3.94169 Clc1cc2[n]c(CNC3CCCCC3)[nH]c2cc1 Amb19664117 [0,1,0,0,0,0|2,0,0]=3 74 B20R3.94169 Clc1cc2[n]c(CNN3CCCCC3)[nH]c2cc1 Amb19664144 [0,1,0,0,0,0|3,0,0]=4 75 B20R3.94169 Nc1cc2[s]c([n]c2cc1)SCC3CCCCO3 Amb22394208 [0,1,0,0,0,0|2,0,0]=3 76 B20R3.94169 Nc1ccc2[n]c([s]c2c1)SCC3CCCCC3 Amb22394226 [0,1,0,0,0,0|1,0,0]=2 77 B20R3.94169 Oc1ccc2c(c1)nc(o2)CCC3CCCCC3 Amb17479268 [0,1,0,0,0,0|2,1,0]=4 78 B20R3.94169 Oc1ccc2c(c1)oc(n2)CCC3CCCCC3 Amb17479181 [0,1,0,0,0,0|2,1,0]=4 79 B20R3.248100 Nc1cccc2c1nc([nH]2)CCC3CCCCC3 Amb17222151 [0,1,0,0,0,0|3,0,0]=4 80 B20R3.248100 Nc1cccc2oc(CCC3CCCCC3)[n]c21 Amb18627031 [0,1,0,0,0,0|2,1,0]=4 81 B20R3.331219 CC(NC1CCSCC1)c2cc3ccccc3[s]2 Amb25416088 [0,1,0,0,0,0|3,0,0]=4 82 B20R3.331219 CN(CC1CCCCN1)c2[n]c3ccccc3[s]2 Amb22293404 [0,1,0,0,0,0|3,0,0]=4 83 B20R3.331219 CN(CC1CCCCO1)c2[n]c3ccccc3[s]2 Amb23607477 [0,1,0,0,0,0|3,0,0]=4 84 B20R3.331219 CN(CC1CCNCC1)c2[n]c3ccccc3[s]2 Amb22293682 [0,1,0,0,0,0|3,0,0]=4 85 B20R3.331219 CN(CC1CNCCC1)c2[n]c3ccccc3[s]2 Amb22293543 [0,1,0,0,0,0|3,0,0]=4 86 B20R3.331219 O=C(C1Cc2c(S1)cccc2)NC3CCCCC3 Amb16125550 [0,1,0,0,0,0|2,0,1]=4 87 B20R3.331219 O=C(NC1CNCCC1)c2cc3ccccc3[s]2 Amb25412077 [0,1,0,0,0,0|3,0,0]=4 88 B20R3.331219 O=C(N[C@@H]1CNCCC1)c2cc3ccccc3[s]2 Amb25416208 [0,1,0,0,0,0|3,0,0]=4 89 B20R3.331219 O=C(c1nc2c(s1)cccc2)NC3CCCCC3 Amb1882579 [0,1,0,0,0,0|1,0,0]=2 90 B20R3.331219 O=S(CC1CCCCN1)c2[n]c3ccccc3[s]2 Amb22299500 [0,1,0,0,0,0|2,0,1]=4 91 B20R3.331219 O=S(CC1CCNCC1)c2[n]c3ccccc3[s]2 Amb22299572 [0,1,0,0,0,0|2,0,1]=4 92 B20R3.331219 O=S(CC1CNCCC1)c2[n]c3ccccc3[s]2 Amb22299536 [0,1,0,0,0,0|2,0,1]=4 93 B20R3.408728 CC1CCN(CC1)SSc2[n]c3ccccc3[s]2 Amb24092949 [0,1,0,0,0,0|2,0,0]=3 94 B20R3.408728 CN1CCC(CC1)NCc2[nH]c3ccccc3[n]2 Amb23912275 [0,1,0,0,0,0|3,0,0]=4 95 B20R3.408728 NC1CCC(CC1)NCc2cc3ccccc3o2 Amb23947732 [0,1,0,0,0,0|2,1,0]=4 96 B20R3.408728 OC1CCC(CC1)NCc2[n]c3ccccc3[s]2 Amb23913281 [0,1,0,0,0,0|1,0,0]=2 97 B20R3.14686862 CC1(CNCCC1)CNc2[n]c3ccccc3[s]2 Amb24804651 [0,1,0,0,0,0|3,0,0]=4 98 B20R3.14686862 CC1(CNc2[n]c3ccccc3[s]2)CCNCC1 Amb24804572 [0,1,0,0,0,0|3,0,0]=4 99 B20R3.14686862 OC1(CNc2[n]c3ccccc3[s]2)CCOCC1 Amb23627271 [0,1,0,0,0,0|3,0,0]=4 100 B18R2.1897 CCOCC(CSc1nc2c(s1)cccc2)O Amb10814291 [0,0,1,0,0,0|3,0,0]=4 101 B18R2.2429 S=C(Nc1ccccc1)NNC2CCCCC2 Amb10554643 [0,0,1,0,0,0|1,0,2]=4 102 B18R2.4165 CCC(CCN)CCc1[n]c2ccccc2[s]1 Amb23985720 [0,0,1,0,0,0|3,0,0]=4 103 B18R2.7339 CCCCCCCSc1nc2c([nH]1)cccc2 Amb1263041 [0,0,1,0,0,0|2,0,0]=3 104 B18R2.7339 CCCCOCCNc1[n]c2ccccc2[s]1 Amb23606006 [0,0,1,0,0,0|3,0,0]=4 105 B18R2.7339 CCCNCCNCc1cc2ccccc2[s]1 Amb25405936 [0,0,1,0,0,0|3,0,0]=4 106 B18R2.7339 CCOCCCNCc1[n]c2ccccc2[s]1 Amb23913321 [0,0,1,0,0,0|2,0,0]=3 107 B18R2.7339 OCCCCCCNc1[n]c2ccccc2[s]1 Amb23806329 [0,0,1,0,0,0|3,0,0]=4 108 B18R3.12728 C(Nc1[n]c2ccccc2[s]1)C3CCCN3 Amb22272058 [0,0,0,0,1,0|3,0,0]=4 109 B18R3.12728 C(Nc1[n]c2ccccc2[s]1)C3CCCN3 Amb24777610 [0,0,0,0,1,0|3,0,0]=4 110 B18R3.12728 C(Oc1[n]c2ccccc2[s]1)C3CCCN3 Amb22272163 [0,0,0,0,1,0|2,1,0]=4 111 B18R3.12728 C(Sc1[nH]c2ccccc2[n]1)C3CCCN3 Amb22272238 [0,0,0,0,1,0|3,0,0]=4 112 B18R3.12728 C(Sc1[nH]c2ccccc2[n]1)C3CCCN3 Amb22395583 [0,0,0,0,1,0|3,0,0]=4 113 B18R3.12728 C(Sc1[n]c2ccccc2[s]1)C3CCCN3 Amb22272245 [0,0,0,0,1,0|2,0,0]=3 114 B18R3.12728 C(Sc1[n]c2ccccc2[s]1)C3CCCN3 Amb22395577 [0,0,0,0,1,0|2,0,0]=3 115 B18R3.12728 C(Sc1[n]c2ccccc2[s]1)C3CNCC3 Amb22272246 [0,0,0,0,1,0|2,0,0]=3 116 B18R3.12728 C(Sc1[n]c2ccccc2o1)C3CCCN3 Amb22272242 [0,0,0,0,1,0|2,1,0]=4 117 B18R3.12728 C(Sc1[n]c2ccccc2o1)C3CCCN3 Amb22395579 [0,0,0,0,1,0|2,1,0]=4 118 B18R3.12728 C1CCC(C1)NCc2nc3c(o2)cccc3 Amb15703939 [0,0,0,0,1,0|1,1,0]=3 119 B18R3.12728 C1COC(C1)CNc2nc3c(s2)cccc3 Amb1103982 [0,0,0,0,1,0|3,0,0]=4 120 B18R3.12728 C1NCCC1CNc2[n]c3ccccc3[s]2 Amb22272059 [0,0,0,0,1,0|3,0,0]=4 121 B18R3.12728 C1NCCC1COc2[n]c3ccccc3[s]2 Amb22272164 [0,0,0,0,1,0|2,1,0]=4 122 B18R3.12728 C1NCCC1CSc2[nH]c3ccccc3[n]2 Amb22272240 [0,0,0,0,1,0|3,0,0]=4 123 B18R3.12728 C1NCCC1CSc2[n]c3ccccc3o2 Amb22272243 [0,0,0,0,1,0|2,1,0]=4 124 B18R3.12875 C1C=CCCC1Nc2[nH]c3ccccc3[n]2 Amb23673204 [0,0,0,0,1,0|1,0,2]=4 125 B18R3.12875 C1C=CCCC1Nc2[n]c3ccccc3[s]2 Amb23663198 [0,0,0,0,1,0|0,0,2]=3 126 B18R3.12875 C1C=CCCC1Nc2[n]c3ccccc3o2 Amb23663153 [0,0,0,0,1,0|0,1,2]=4 127 B18R3.12875 C1CC(CCN1)Nc2[nH]c3[n]cccc3[n]2 Amb22272334 [0,0,0,0,1,0|3,0,0]=4 128 B18R3.12875 C1CC(CCN1)Nc2[n]c3ccccc3[s]2 Amb22272331 [0,0,0,0,1,0|1,0,0]=2 129 B18R3.12875 C1CC(CCN1)Nc2[n]c3ccccc3o2 Amb22272332 [0,0,0,0,1,0|1,1,0]=3 130 B18R3.12875 C1CC(CCN1)Oc2[n]c3ccccc3[s]2 Amb21936748 [0,0,0,0,1,0|1,1,0]=3 131 B18R3.12875 C1CC(CCN1)Oc2[n]c3ccccc3o2 Amb22272335 [0,0,0,0,1,0|1,2,0]=4 132 B18R3.12875 C1CC(CCN1)Sc2[nH]c3ccccc3[n]2 Amb22395540 [0,0,0,0,1,0|2,0,0]=3 133 B18R3.12875 C1CC(CCN1)Sc2[n]c3ccccc3o2 Amb22395534 [0,0,0,0,1,0|1,1,0]=3 134 B18R3.12875 C1CCC(CC1)Cn2nc3c(n2)cccc3 Amb10560216 [0,0,0,0,1,0|3,0,0]=4 135 B18R3.12875 C1CCC(CC1)Nc2nc3c(o2)cccc3 Amb11277897 [0,0,0,0,1,0|0,1,0]=2 136 B18R3.12875 C1CCC(CC1)Nc2nc3c(s2)cccc3 Amb2372255 [0,0,0,0,1,0|0,0,0]=1 137 B18R3.12875 C1CCC(CN1)Nc2nc3c([nH]2)cccc3 Amb10598616 [0,0,0,0,1,0|2,0,0]=3 138 B18R3.12875 C1CCC(CN1)Nc2nc3c(s2)cccc3 Amb10598636 [0,0,0,0,1,0|1,0,0]=2 139 B18R3.12875 C1CCC(CN1)Oc2nc3c([nH]2)cccc3 Amb10598622 [0,0,0,0,1,0|2,1,0]=4 140 B18R3.12875 C1CCC(CN1)Oc2nc3c(s2)cccc3 Amb10598633 [0,0,0,0,1,0|1,1,0]=3 141 B18R3.12875 C1CCCCC1Sc2[nH]c3ccccc3[n]2 Amb22539831 [0,0,0,0,1,0|1,0,0]=2 142 B18R3.12875 C1CCN(CC1)Cc2nc3c(s2)cccc3 Amb10683488 [0,0,0,0,1,0|2,0,0]=3 143 B18R3.12875 C1NCCCC1Nc2[nH]c3[n]cccc3[n]2 Amb22272421 [0,0,0,0,1,0|3,0,0]=4 144 B18R3.12875 C1NCCCC1Nc2[nH]c3ccccc3[n]2 Amb22032901 [0,0,0,0,1,0|2,0,0]=3 145 B18R3.12875 C1NCCCC1Nc2[n]c3ccccc3[s]2 Amb20616631 [0,0,0,0,1,0|1,0,0]=2 146 B18R3.12875 C1NCCCC1Nc2[n]c3ccccc3o2 Amb21859679 [0,0,0,0,1,0|1,1,0]=3 147 B18R3.12875 C1NCCCC1Nc2[n]c3ccccc3o2 Amb22274207 [0,0,0,0,1,0|1,1,0]=3 148 B18R3.12875 C1NCCCC1Oc2[n]c3ccccc3o2 Amb22272424 [0,0,0,0,1,0|1,2,0]=4 149 B18R3.12875 C1NCCCC1Sc2[nH]c3ccccc3[n]2 Amb22272432 [0,0,0,0,1,0|2,0,0]=3 150 B18R3.12875 C1NCCCC1Sc2[n]c3ccccc3[s]2 Amb22272434 [0,0,0,0,1,0|1,0,0]=2 151 B18R3.12875 C1NCCCC1Sc2[n]c3ccccc3o2 Amb22272433 [0,0,0,0,1,0|1,1,0]=3 152 B18R3.12875 C1NCCC[C@@H]1Nc2[nH]c3[n]cccc3[n]2 Amb22272407 [0,0,0,0,1,0|3,0,0]=4 153 B18R3.12875 C1NCCC[C@@H]1Nc2[nH]c3ccccc3[n]2 Amb22272404 [0,0,0,0,1,0|2,0,0]=3 154 B18R3.12875 C1NCCC[C@@H]1Nc2[n]c3ccccc3[s]2 Amb22272406 [0,0,0,0,1,0|1,0,0]=2 155 B18R3.12875 C1NCCC[C@@H]1Nc2[n]c3ccccc3o2 Amb22272405 [0,0,0,0,1,0|1,1,0]=3 156 B18R3.12875 C1NCCC[C@@H]1Oc2[nH]c3ccccc3[n]2 Amb22272413 [0,0,0,0,1,0|2,1,0]=4 157 B18R3.12875 C1NCCC[C@@H]1Oc2[n]c3ccccc3[s]2 Amb22272415 [0,0,0,0,1,0|1,1,0]=3 158 B18R3.12875 C1NCCC[C@@H]1Oc2[n]c3ccccc3o2 Amb22272414 [0,0,0,0,1,0|1,2,0]=4 159 B18R3.12875 C1NCCC[C@H]1Nc2[nH]c3[n]cccc3[n]2 Amb22272387 [0,0,0,0,1,0|3,0,0]=4 160 B18R3.12875 C1NCCC[C@H]1Nc2[nH]c3ccccc3[n]2 Amb22272384 [0,0,0,0,1,0|2,0,0]=3 161 B18R3.12875 C1NCCC[C@H]1Nc2[n]c3ccccc3[s]2 Amb22272386 [0,0,0,0,1,0|1,0,0]=2 162 B18R3.12875 C1NCCC[C@H]1Nc2[n]c3ccccc3o2 Amb22272385 [0,0,0,0,1,0|1,1,0]=3 163 B18R3.12875 C1NCCC[C@H]1Oc2[nH]c3ccccc3[n]2 Amb22272392 [0,0,0,0,1,0|2,1,0]=4 164 B18R3.12875 C1NCCC[C@H]1Oc2[n]c3ccccc3[s]2 Amb22272395 [0,0,0,0,1,0|1,1,0]=3 165 B18R3.12875 C1NCCC[C@H]1Oc2[n]c3ccccc3o2 Amb22272393 [0,0,0,0,1,0|1,2,0]=4 166 B18R3.12875 C1SCCCC1Nc2[nH]c3ccccc3[n]2 Amb23776022 [0,0,0,0,1,0|2,0,0]=3 167 B18R3.12875 N1CCC(CC1)Nc2nc3c([nH]2)cccc3 Amb10598615 [0,0,0,0,1,0|2,0,0]=3 168 B18R3.12875 N1CCC(CC1)Oc2nc3c([nH]2)cccc3 Amb10598621 [0,0,0,0,1,0|2,1,0]=4 169 B18R3.12875 N1CCC(CC1)Oc2nc3c(s2)cccc3 Amb10598632 [0,0,0,0,1,0|1,1,0]=3 170 B18R3.12875 N1CCC(CC1)Sc2nc3c([nH]2)cccc3 Amb17066044 [0,0,0,0,1,0|2,0,0]=3 171 B18R3.12875 N1CCC(CC1)Sc2nc3c(o2)cccc3 Amb17066304 [0,0,0,0,1,0|1,1,0]=3 172 B18R3.12875 N1CCC(CC1)Sc2nc3c(s2)cccc3 Amb10808388 [0,0,0,0,1,0|1,0,0]=2 173 B18R3.12875 N1CCC(CC1)Sc2nc3c(s2)cccc3 Amb17066048 [0,0,0,0,1,0|1,0,0]=2 174 B18R3.12875 O1CCC(CC1)Nc2nc3c(o2)cccc3 Amb15719185 [0,0,0,0,1,0|1,1,0]=3 175 B18R3.12875 O1CCN(CC1)Sc2nc3c(s2)cccc3 Amb1148815 [0,0,0,0,1,0|2,0,0]=3 176 B20R3.30190 C(Sc1c[n]c2ccccc2[n]1)C3CCCCN3 Amb22272217 [0,0,0,0,0,1|3,0,0]=4 177 B20R3.30190 C(Sc1c[n]c2ccccc2[n]1)C3CCNCC3 Amb22272221 [0,0,0,0,0,1|3,0,0]=4 178 B20R3.30190 C(Sc1c[n]c2ccccc2[n]1)C3CNCCC3 Amb22272219 [0,0,0,0,0,1|3,0,0]=4 179 B20R3.30260 C(CC1CCCCN1)Oc2[n]c3ccccc3[s]2 Amb22271905 [0,0,0,0,0,1|2,1,0]=4 180 B20R3.30260 C(CC1CCCCN1)Sc2[n]c3ccccc3[s]2 Amb22395647 [0,0,0,0,0,1|2,0,0]=3 181 B20R3.30260 C(CC1CCCCN1)Sc2[n]c3ccccc3o2 Amb22395653 [0,0,0,0,0,1|2,1,0]=4 182 B20R3.30260 C(CC1CCNCC1)Sc2[n]c3ccccc3[s]2 Amb22395698 [0,0,0,0,0,1|2,0,0]=3 183 B20R3.30260 C(CN1CCCCC1)Nc2[n]c3ccccc3[s]2 Amb23609920 [0,0,0,0,0,1|3,0,0]=4 184 B20R3.30260 C(CN1CCCCC1)Sc2[nH]c3ccccc3[n]2 Amb21866896 [0,0,0,0,0,1|3,0,0]=4 185 B20R3.30260 C(NCC1CCCCC1)c2[nH]c3ccccc3[n]2 Amb19558322 [0,0,0,0,0,1|2,0,0]=3 186 B20R3.30260 C1CC(CCOc2[n]c3ccccc3[s]2)CCN1 Amb22271942 [0,0,0,0,0,1|2,1,0]=4 187 B20R3.30260 C1CC(CCSc2[nH]c3ccccc3[n]2)CCN1 Amb22395707 [0,0,0,0,0,1|3,0,0]=4 188 B20R3.30260 C1CC(CCSc2[n]c3ccccc3o2)CCN1 Amb22395701 [0,0,0,0,0,1|2,1,0]=4 189 B20R3.30260 C1CCC(CC1)CCSc2nc3c([nH]2)cccc3 Amb1054343 [0,0,0,0,0,1|2,0,0]=3 190 B20R3.30260 C1CCC(CC1)\C=N\Nc2nc3c([nH]2)cccc3 Amb2254268 [0,0,0,0,0,1|2,0,1]=4 191 B20R3.30260 C1CCCC(CCSc2[nH]c3ccccc3[n]2)N1 Amb22395662 [0,0,0,0,0,1|3,0,0]=4 192 B20R3.30260 C1CCN(CC1)CCSc2nc3c([nH]2)cccc3 Amb1018359 [0,0,0,0,0,1|3,0,0]=4 193 B20R3.30260 C1CCN(CC1)CCSc2nc3c(s2)cccc3 Amb1922893 [0,0,0,0,0,1|2,0,0]=3 194 B20R3.30260 C1NCCCC1CCNc2[n]c3ccccc3[s]2 Amb23970751 [0,0,0,0,0,1|3,0,0]=4 195 B20R3.30260 C1NCCCC1CCOc2[n]c3ccccc3[s]2 Amb22271923 [0,0,0,0,0,1|2,1,0]=4 196 B17R2.2569 CCCCCCNc1nc2c([nH]1)cccc2 Amb16906757 [1,0,1,0,0,0|1,0,0]=3 197 B17R2.2569 CCCCCCNc1nc2c(s1)cccc2 Amb1103948 [1,0,1,0,0,0|0,0,0]=2 198 B17R2.2569 CCCCCCSc1nc2c([nH]1)cccc2 Amb1097016 [1,0,1,0,0,0|1,0,0]=3 199 B17R2.2569 CCCNCCNc1[nH]c2ccccc2[n]1 Amb24778565 [1,0,1,0,0,0|2,0,0]=4 200 B17R2.2569 CCCNCCNc1[n]c2ccccc2[s]1 Amb24778579 [1,0,1,0,0,0|1,0,0]=3 201 B17R2.2569 CCCNCCNc1[n]c2ccccc2o1 Amb24778595 [1,0,1,0,0,0|1,1,0]=4 202 B17R2.2569 CCCNCCSc1[nH]c2ccccc2[n]1 Amb20573318 [1,0,1,0,0,0|2,0,0]=4 203 B17R2.2569 CCCNCCSc1[n]c2ccccc2[s]1 Amb20573245 [1,0,1,0,0,0|1,0,0]=3 204 B17R2.2569 CCCNCCSc1[n]c2ccccc2o1 Amb20414347 [1,0,1,0,0,0|1,1,0]=4 205 B17R2.2569 CSCCCCNc1[nH]c2ccccc2[n]1 Amb23775489 [1,0,1,0,0,0|2,0,0]=4 206 B17R2.2569 CSCCCCNc1[n]c2ccccc2[s]1 Amb23662362 [1,0,1,0,0,0|1,0,0]=3 207 B17R2.2569 CSCCCCNc1[n]c2ccccc2o1 Amb23662320 [1,0,1,0,0,0|1,1,0]=4 208 B17R2.2569 N#CCCCCNc1[n]c2ccccc2[s]1 Amb23627705 [1,0,1,0,0,0|1,0,1]=4 209 B17R2.2569 OCCNCCSc1nc2c(s1)cccc2 Amb23163 [1,0,1,0,0,0|2,0,0]=4 210 B17R2.2569 OCCOCCNc1[n]c2ccccc2[s]1 Amb19420634 [1,0,1,0,0,0|2,0,0]=4 211 B17R2.2382 C(\C=C\c1ccccc1)NC2CCCCC2 Amb22280277 [1,0,1,0,0,0|2,0,0]=4 212 B17R2.5532 CCC(CC)NCc1[nH]c2ccccc2[n]1 Amb22393168 [1,0,1,0,0,0|2,0,0]=4 213 B19R2.4703 CCC(CCC)NCc1[n]c2ccccc2[n]1C Amb24799152 [0,1,1,0,0,0|2,0,0]=4 214 B19R2.121686 CCCC(CCN)CCc1[n]c2ccccc2[s]1 Amb23986056 [0,1,1,0,0,0|2,0,0]=4 215 B19R2.121686 CCOC(CSc1nc2c(s1)cccc2)OCC Amb2574989 [0,1,1,0,0,0|2,0,0]=4 216 B19R2.1283 CCCCCCCSc1[n]c2ccc(N)cc2[s]1 Amb22394187 [0,1,1,0,0,0|1,0,0]=3 217 B19R2.12592 CCC(CCCCNc1nc2c(s1)cccc2)C Amb1103964 [0,1,1,0,0,0|2,0,0]=4 218 B19R2.13041 CCCCCCCCSc1nc2c([nH]1)cccc2 Amb1667103 [0,1,1,0,0,0|2,0,0]=4 219 B19R2.13041 CCCCCCNCCc1[nH]c2ccccc2[n]1 Amb18620785 [0,1,1,0,0,0|2,0,0]=4 220 B19R3.6053 C[n]1c2ccccc2[n]c1CNC3CCCC3 Amb24786443 [0,1,0,0,1,0|2,0,0]=4 221 B19R3.55731 Cc1cc2[n]c(CNC3CCCC3)oc2cc1 Amb23921984 [0,1,0,0,1,0|1,1,0]=4 222 B19R3.55731 Clc1cc2[n]c(CNC3CCCC3)[nH]c2cc1 Amb19664115 [0,1,0,0,1,0|2,0,0]=4 223 B19R3.55731 Nc1cc2[s]c(NCC3CCCC3)[n]c2cc1 Amb23963424 [0,1,0,0,1,0|2,0,0]=4 224 B19R3.55731 Nc1cc2[s]c([n]c2cc1)SCC3CCCO3 Amb22394217 [0,1,0,0,1,0|2,0,0]=4 225 B19R3.2395099 NC1(COc2[n]c3ccccc3[s]2)CCCC1 Amb23989376 [0,1,0,0,1,0|1,1,0]=4 226 B19R3.2395099 OC1(CNc2[n]c3ccccc3[s]2)CCCC1 Amb23607685 [0,1,0,0,1,0|2,0,0]=4 227 B19R3.182 C[n]1c(NC2CNCCC2)[n]c3ccccc13 Amb23984834 [0,1,0,0,1,0|2,0,0]=4 228 B19R3.182 C[n]1c(NC2COCCC2)[n]c3ccccc13 Amb23984816 [0,1,0,0,1,0|2,0,0]=4 229 B19R3.8304 Cc1cccc2[s]c(NC3CCCCC3)[n]c21 Amb18940138 [0,1,0,0,1,0|0,0,0]=2 230 B19R3.8304 Clc1cccc2[s]c(NC3CCCCC3)[n]c21 Amb18274105 [0,1,0,0,1,0|0,0,0]=2 231 B19R3.8304 Clc1cccc2[s]c([n]c21)OC3CCNCC3 Amb21936747 [0,1,0,0,1,0|1,1,0]=4 232 B19R3.8304 Clc1cccc2c1nc(s2)NC3CCNCC3 Amb17515778 [0,1,0,0,1,0|1,0,0]=3 233 B19R3.8304 Fc1cccc2[s]c(NC3CCCCC3)[n]c21 Amb18274735 [0,1,0,0,1,0|0,0,0]=2 234 B19R3.8304 Nc1cccc2oc(CC3CCCCC3)[n]c21 Amb18627049 [0,1,0,0,1,0|1,1,0]=4 235 B19R3.54463 CC1CCCN(C1)Cc2nc3c(s2)cccc3 Amb10671450 [0,1,0,0,1,0|2,0,0]=4 236 B19R3.54463 N[C@H]1CN(Cc2[n]c3ccccc3[s]2)CCC1 Amb24795771 [0,1,0,0,1,0|2,0,0]=4 237 B19R3.54463 OC1CCCN(C1)Cc2nc3c(s2)cccc3 Amb10613372 [0,1,0,0,1,0|2,0,0]=4 238 B19R3.88146 Brc1cc2[n]c(CC3CNCCC3)[s]c2cc1 Amb23952473 [0,1,0,0,1,0|2,0,0]=4 239 B19R3.88146 Brc1cc2[s]c(NC3CCCCC3)[n]c2cc1 Amb18274852 [0,1,0,0,1,0|0,0,0]=2 240 B19R3.88146 Brc1ccc2[nH]c(NC3CCNCC3)[n]c2c1 Amb18340176 [0,1,0,0,1,0|2,0,0]=4 241 B19R3.88146 Cc1cc2[n]c(CC3CNCCC3)[s]c2cc1 Amb23952470 [0,1,0,0,1,0|2,0,0]=4 242 B19R3.88146 Cc1cc2[n]c([nH]c2cc1)SC3CNCCC3 Amb23956538 [0,1,0,0,1,0|2,0,0]=4 243 B19R3.88146 Cc1cc2[s]c(NC3CCCCC3)[n]c2cc1 Amb18940152 [0,1,0,0,1,0|0,0,0]=2 244 B19R3.88146 Cc1ccc2c(c1)nc([nH]2)NC3CCCCC3 Amb16906772 [0,1,0,0,1,0|1,0,0]=3 245 B19R3.88146 Cc1ccc2c(c1)sc(n2)NC3CCNCC3 Amb17515770 [0,1,0,0,1,0|1,0,0]=3 246 B19R3.88146 Clc1cc2[n]c(CC3CNCCC3)[s]c2cc1 Amb23952469 [0,1,0,0,1,0|2,0,0]=4 247 B19R3.88146 Clc1cc2[s]c(NC3CCCCC3)[n]c2cc1 Amb18274912 [0,1,0,0,1,0|0,0,0]=2 248 B19R3.88146 Clc1ccc2[nH]c(NC3CCNCC3)[n]c2c1 Amb19095490 [0,1,0,0,1,0|2,0,0]=4 249 B19R3.88146 Clc1ccc2[n]c(oc2c1)SC3CCOCC3 Amb24262976 [0,1,0,0,1,0|1,1,0]=4 250 B19R3.88146 Fc1cc2[n]c(NC3CCSCC3)oc2cc1 Amb23653102 [0,1,0,0,1,0|1,1,0]=4 251 B19R3.88146 Fc1cc2[n]c(NC3COCCC3)oc2cc1 Amb23653118 [0,1,0,0,1,0|1,1,0]=4 252 B19R3.88146 Fc1cc2[s]c(NC3CCCCC3)[n]c2cc1 Amb18274571 [0,1,0,0,1,0|0,0,0]=2 253 B19R3.88146 Fc1ccc2c(c1)sc(n2)NC3CCNCC3 Amb17515780 [0,1,0,0,1,0|1,0,0]=3 254 B19R3.88146 Nc1cc2[s]c(NC3CCOCC3)[n]c2cc1 Amb23963436 [0,1,0,0,1,0|1,0,0]=3 255 B19R3.88146 Nc1cc2[s]c([n]c2cc1)SC3CCCCC3 Amb22394191 [0,1,0,0,1,0|0,0,0]=2 256 B19R3.88146 Nc1ccc2[n]c(OC3CCOCC3)[s]c2c1 Amb23963495 [0,1,0,0,1,0|1,1,0]=4 257 B19R3.171030 NC1CCCCC1Nc2[nH]c3[n]cccc3[n]2 Amb22294581 [0,1,0,0,1,0|2,0,0]=4 258 B19R3.171030 NC1CCCCC1Nc2[nH]c3ccccc3[n]2 Amb22294578 [0,1,0,0,1,0|1,0,0]=3 259 B19R3.171030 NC1CCCCC1Nc2[n]c3ccccc3[s]2 Amb22294580 [0,1,0,0,1,0|0,0,0]=2 260 B19R3.171030 NC1CCCCC1Nc2[n]c3ccccc3o2 Amb22294579 [0,1,0,0,1,0|0,1,0]=3 261 B19R3.171030 NC1CCCCC1Sc2cc3ccccc3[nH]2 Amb24042329 [0,1,0,0,1,0|1,0,1]=4 262 B19R3.171030 O=C1CCCCC1Sc2nc3c([nH]2)cccc3 Amb1543331 [0,1,0,0,1,0|1,0,1]=4 263 B19R3.171030 O=C1CCCCC1Sc2nc3c(o2)cccc3 Amb1031405 [0,1,0,0,1,0|0,1,1]=4 264 B19R3.171030 OC1CCCCC1Sc2cc3ccccc3[nH]2 Amb24042250 [0,1,0,0,1,0|1,0,1]=4 265 B19R3.171030 O[C@H]1CCCC[C@@H]1Nc2[nH]c3ccccc3[n]2 Amb23865996 [0,1,0,0,1,0|1,0,0]=3 266 B19R3.171030 O[C@H]1CCCC[C@@H]1Nc2[n]c3ccccc3[s]2 Amb23865665 [0,1,0,0,1,0|0,0,0]=2 267 B19R3.171030 O[C@H]1CCCC[C@@H]1Nc2[n]c3ccccc3o2 Amb23865725 [0,1,0,0,1,0|0,1,0]=3 268 B19R3.241821 CC1CCC(CC1)Nc2nc3c(o2)cccc3 Amb10705687 [0,1,0,0,1,0|0,1,0]=3 269 B19R3.241821 CN1CCC(CC1)Nc2[nH]c3ccccc3[n]2 Amb23922432 [0,1,0,0,1,0|2,0,0]=4 270 B19R3.241821 NC1CCC(CC1)Nc2[nH]c3[n]cccc3[n]2 Amb22294522 [0,1,0,0,1,0|2,0,0]=4 271 B19R3.241821 NC1CCC(CC1)Nc2[nH]c3ccccc3[n]2 Amb22294519 [0,1,0,0,1,0|1,0,0]=3 272 B19R3.241821 NC1CCC(CC1)Nc2[n]c3ccccc3[s]2 Amb22294521 [0,1,0,0,1,0|0,0,0]=2 273 B19R3.241821 NC1CCC(CC1)Nc2[n]c3ccccc3o2 Amb22294520 [0,1,0,0,1,0|0,1,0]=3 274 B19R3.241821 NC1CCC(CC1)Sc2[nH]c3ccccc3[n]2 Amb22395679 [0,1,0,0,1,0|1,0,0]=3 275 B19R3.241821 NC1CCC(CC1)Sc2[n]c3ccccc3[s]2 Amb22395672 [0,1,0,0,1,0|0,0,0]=2 276 B19R3.241821 NC1CCC(CC1)Sc2[n]c3ccccc3o2 Amb22395674 [0,1,0,0,1,0|0,1,0]=3 277 B19R3.241821 N[C@@H]1CC[C@H](CC1)Nc2[nH]c3[n]cccc3[n]2 Amb24059481 [0,1,0,0,1,0|2,0,0]=4 278 B19R3.241821 N[C@@H]1CC[C@H](CC1)Nc2[nH]c3ccccc3[n]2 Amb24059515 [0,1,0,0,1,0|1,0,0]=3 279 B19R3.241821 N[C@@H]1CC[C@H](CC1)Nc2[n]c3ccccc3[s]2 Amb24059512 [0,1,0,0,1,0|0,0,0]=2 280 B19R3.241821 N[C@@H]1CC[C@H](CC1)Nc2[n]c3ccccc3o2 Amb24059484 [0,1,0,0,1,0|0,1,0]=3 281 B19R3.241821 O=C1CCC(CN1)Nc2[n]c3ccccc3[s]2 Amb23628444 [0,1,0,0,1,0|1,0,1]=4 282 B19R3.241821 OC1CCN(CC1)Cc2nc3c(s2)cccc3 Amb15850392 [0,1,0,0,1,0|2,0,0]=4 283 B19R3.241821 O[C@@H]1CC[C@H](CC1)Nc2[nH]c3[n]cccc3[n]2 Amb24059628 [0,1,0,0,1,0|2,0,0]=4 284 B19R3.241821 O[C@@H]1CC[C@H](CC1)Nc2[nH]c3ccccc3[n]2 Amb18339759 [0,1,0,0,1,0|1,0,0]=3 285 B19R3.241821 O[C@@H]1CC[C@H](CC1)Nc2[n]c3ccccc3[s]2 Amb23673505 [0,1,0,0,1,0|0,0,0]=2 286 B19R3.241821 O[C@@H]1CC[C@H](CC1)Nc2[n]c3ccccc3o2 Amb24059627 [0,1,0,0,1,0|0,1,0]=3 287 B19R3.1799922 CN(C1CCCCC1)c2[n]c3ccccc3[s]2 Amb20720188 [0,1,0,0,1,0|0,0,0]=2 288 B19R3.1799922 CN(C1CCNCC1)c2[nH]c3ccccc3[n]2 Amb22293204 [0,1,0,0,1,0|2,0,0]=4 289 B19R3.1799922 CN(C1CCNCC1)c2[n]c3ccccc3[s]2 Amb22293206 [0,1,0,0,1,0|1,0,0]=3 290 B19R3.1799922 CN(C1CCNCC1)c2[n]c3ccccc3o2 Amb22293205 [0,1,0,0,1,0|1,1,0]=4 291 B19R3.1799922 CN(C1CCOCC1)c2[nH]c3ccccc3[n]2 Amb23775752 [0,1,0,0,1,0|2,0,0]=4 292 B19R3.1799922 CN(C1CNCCC1)c2[nH]c3ccccc3[n]2 Amb22293091 [0,1,0,0,1,0|2,0,0]=4 293 B19R3.1799922 CN(C1CNCCC1)c2[n]c3ccccc3[s]2 Amb22293092 [0,1,0,0,1,0|1,0,0]=3 294 B19R3.1799922 CN(C1CNCCC1)c2[n]c3ccccc3o2 Amb22274205 [0,1,0,0,1,0|1,1,0]=4 295 B19R3.1799922 CN([C@@H]1CNCCC1)c2[nH]c3ccccc3[n]2 Amb22292991 [0,1,0,0,1,0|2,0,0]=4 296 B19R3.1799922 CN([C@@H]1CNCCC1)c2[n]c3ccccc3[s]2 Amb22292993 [0,1,0,0,1,0|1,0,0]=3 297 B19R3.1799922 CN([C@@H]1CNCCC1)c2[n]c3ccccc3o2 Amb22292992 [0,1,0,0,1,0|1,1,0]=4 298 B19R3.1799922 CN([C@H]1CNCCC1)c2[nH]c3ccccc3[n]2 Amb22292887 [0,1,0,0,1,0|2,0,0]=4 299 B19R3.1799922 CN([C@H]1CNCCC1)c2[n]c3ccccc3[s]2 Amb22292889 [0,1,0,0,1,0|1,0,0]=3 300 B19R3.1799922 CN([C@H]1CNCCC1)c2[n]c3ccccc3o2 Amb22292888 [0,1,0,0,1,0|1,1,0]=4 301 B19R3.1799922 CN(c1nc2c(o1)cccc2)C3CCCCC3 Amb10698613 [0,1,0,0,1,0|0,1,0]=3 302 B19R3.1799922 NC(C1CCCCC1)c2[n]c3ccc[n]c3[s]2 Amb24001877 [0,1,0,0,1,0|2,0,0]=4 303 B19R3.1799922 O=C(C1CCNCC1)c2[n]c3ccccc3[s]2 Amb20220695 [0,1,0,0,1,0|2,0,0]=4 304 B19R3.1799922 O=C(c1nc2c(s1)cccc2)N3CCCCC3 Amb1882583 [0,1,0,0,1,0|2,0,0]=4 305 B19R3.1799922 O=S(C1CCNCC1)c2[n]c3ccccc3[s]2 Amb22299464 [0,1,0,0,1,0|1,0,1]=4 306 B19R3.1799922 O=S(C1CNCCC1)c2[n]c3ccccc3[s]2 Amb22295712 [0,1,0,0,1,0|1,0,1]=4 307 B19R3.1799922 OC(C1CCCCC1)c2cc3ccccc3[s]2 Amb22263509 [0,1,0,0,1,0|2,0,0]=4 308 B19R3.7620222 NC1(Cc2[nH]c3ccccc3[n]2)CCCCC1 Amb22013084 [0,1,0,0,1,0|2,0,0]=4 309 B21R3.24438 O=C(NC1CCCCC1)c2[n]c3ccccc3[n][n]2 Amb23471212 [0,1,0,0,0,1|2,0,0]=4 310 B21R3.24438 O=C(c1ccc2c(n1)cccc2)NC3CCCCC3 Amb1547831 [0,1,0,0,0,1|2,0,0]=4 311 B21R3.13048 C[n]1c2ccccc2[n]c1CNCC3CCCCC3 Amb24813194 [0,1,0,0,0,1|2,0,0]=4 312 B21R3.24408 O=C(C1CCCCC1)NNc2nc3c(s2)cccc3 Amb1951799 [0,1,0,0,0,1|1,0,0]=3 313 B21R3.24408 O=C(C1CCCCC1)OCc2nc3c(s2)cccc3 Amb2296765 [0,1,0,0,0,1|1,1,0]=4 314 B21R3.24408 O=C(NCc1[n]c2ccccc2[s]1)C3CCCCN3 Amb24809845 [0,1,0,0,0,1|2,0,0]=4 315 B21R3.24408 O=C(NCc1[n]c2ccccc2[s]1)C3CCNCC3 Amb24809843 [0,1,0,0,0,1|2,0,0]=4 316 B21R3.24408 O=C(NCc1[n]c2ccccc2[s]1)C3CNCCC3 Amb24809844 [0,1,0,0,0,1|2,0,0]=4 317 B21R3.154845 Cc1cc2[n]c(CCNC3CCCCC3)[nH]c2cc1 Amb18620812 [0,1,0,0,0,1|2,0,0]=4 318 B21R3.154845 Cc1ccc2c(c1)nc([nH]2)SCCC3CCCCC3 Amb1097108 [0,1,0,0,0,1|2,0,0]=4 319 B21R3.154845 Clc1cc2[n]c(CCNC3CCCCC3)[nH]c2cc1 Amb18620814 [0,1,0,0,0,1|2,0,0]=4 320 B21R3.154845 Clc1cc2[n]c(CNCC3CCCCC3)[nH]c2cc1 Amb22393130 [0,1,0,0,0,1|2,0,0]=4 321 B21R3.154845 Clc1ccc2c(c1)nc([nH]2)SCCC3CCCCC3 Amb1097123 [0,1,0,0,0,1|2,0,0]=4 322 B21R3.154845 Fc1cc2[n]c(CCNC3CCCCC3)[nH]c2cc1 Amb18104109 [0,1,0,0,0,1|2,0,0]=4 323 B21R3.154845 Nc1cc2[s]c([n]c2cc1)SCCC3CCCCC3 Amb22394245 [0,1,0,0,0,1|1,0,0]=3 324 B21R3.154845 Oc1cc2[n]c(CCNC3CCCCC3)[nH]c2cc1 Amb18620811 [0,1,0,0,0,1|2,0,0]=4 325 B21R3.217517 CC1CCCCC1NCCc2[nH]c3ccccc3[n]2 Amb18104170 [0,1,0,0,0,1|2,0,0]=4 326 B21R3.520681 CN(Cc1[n]c2ccccc2[s]1)CC3CCCCC3 Amb20790732 [0,1,0,0,0,1|1,0,0]=3 327 B21R3.520681 CN(Cc1[n]c2ccccc2[s]1)CC3CCCCO3 Amb21536134 [0,1,0,0,0,1|2,0,0]=4 328 B21R3.520681 CN(Cc1[n]c2ccccc2[s]1)CC3CCNCC3 Amb25423185 [0,1,0,0,0,1|2,0,0]=4 329 B21R3.520681 O=C(NC1CCCCC1)\N=C\2/Nc3ccccc3S2 Amb22562468 [0,1,0,0,0,1|1,0,1]=4 330 B21R3.248685 C[n]1c2ccccc2[n]c1CNC3CCCCCC3 Amb24813174 [0,1,0,0,0,1|2,0,0]=4 331 B21R3.410258 O=C1CCCCCN1CSc2nc3c(s2)cccc3 Amb1983770 [0,1,0,0,0,1|2,0,0]=4 332 B21R3.25251354 OC1(CNc2[n]c3ccccc3[s]2)CCCCCC1 Amb23656982 [0,1,0,0,0,1|2,0,0]=4 333 B21R3.28029735 Cc1cc2[n]c(CNC3CCCCCC3)[nH]c2cc1 Amb19664083 [0,1,0,0,0,1|2,0,0]=4 334 B21R3.28029735 Clc1cc2[n]c(CNC3CCCCCC3)[nH]c2cc1 Amb19664119 [0,1,0,0,0,1|2,0,0]=4 335 B21R3.7872 CC1CCCC(C1)NCc2[n]c3ccccc3[n]2C Amb24813193 [0,2,0,0,0,0|2,0,0]=4 336 B21R3.8338 CC1CCCCC1NCc2[n]c3ccccc3[n]2C Amb24813169 [0,2,0,0,0,0|2,0,0]=4 337 B21R3.13071 C\C(=C/1\Sc2c(C1=O)cccc2)\NC3CCCCC3 Amb1630830 [0,2,0,0,0,0|2,0,0]=4 338 B21R3.13071 C\C(\NC1CCCCC1)=C\2/Sc3ccccc3C2=O Amb19543888 [0,2,0,0,0,0|2,0,0]=4 339 B21R3.13071 O=C(c1sc2c(c1Cl)cccc2)NC3CCCCC3 Amb2458354 [0,2,0,0,0,0|2,0,0]=4 340 B21R3.13081 CN(C1CCCCC1)Cc2nc3c(n2C)cccc3 Amb1927815 [0,2,0,0,0,0|2,0,0]=4 341 B21R3.29713 C[n]1c(CNC2CCC(O)CC2)[n]c3ccccc13 Amb24813168 [0,2,0,0,0,0|2,0,0]=4 342 B21R3.154841 CN(Cc1[nH]c2ccc(F)cc2[n]1)C3CCCCC3 Amb18620135 [0,2,0,0,0,0|2,0,0]=4 343 B21R3.154841 CN(Cc1[n]c2cc(Cl)ccc2[s]1)C3CCNCC3 Amb23509258 [0,2,0,0,0,0|2,0,0]=4 344 B21R3.154841 O=C(C1CCCCC1)Nc2nc3c(s2)cc(cc3)C Amb1544962 [0,2,0,0,0,0|2,0,0]=4 345 B21R3.14886901 CC(c1[nH]c2ccccc2[n]1)N(C)C3CCCCC3 Amb18103982 [0,2,0,0,0,0|2,0,0]=4 346 B21R3.14886901 CN(C1CCCCC1)C(=O)c2cc3ccccc3[s]2 Amb21634160 [0,2,0,0,0,0|2,0,0]=4 347 B21R3.14886901 O=C(N(c1nc2c(s1)cccc2)N)C3CCCCC3 Amb1044834 [0,2,0,0,0,0|2,0,0]=4 348 B21R3.3957577 CC1CCCCC1NC(=O)c2nc3c([nH]2)cccc3 Amb10790511 [0,2,0,0,0,0|2,0,0]=4 349 B21R3.3957577 OC1CCCCC1NC(=O)c2[nH]c3ccccc3[n]2 Amb19498421 [0,2,0,0,0,0|2,0,0]=4 350 B21R3.3969596 CC1(CNc2[n]c3ccccc3[s]2)CCCCC1O Amb23700223 [0,2,0,0,0,0|2,0,0]=4 351 B21R3.393361 O=C(c1sc2c(c1)c(F)ccc2)NC3CCCCC3 Amb142543 [0,2,0,0,0,0|2,0,0]=4 352 B21R3.659958 CC1CCC(CC1)NC(=O)c2cc3c(s2)cccc3 Amb189182 [0,2,0,0,0,0|2,0,0]=4 353 B21R3.23765488 O=S(=O)(NC1CCCCC1)c2[n]c3ccccc3[s]2 Amb20075882 [0,2,0,0,0,0|0,0,1]=3 354 B21R3.23765488 O=S(=O)(NC1CCNCC1)c2[n]c3ccccc3[s]2 Amb22295677 [0,2,0,0,0,0|1,0,1]=4 355 B21R3.23765488 O=S(=O)(NC1CNCCC1)c2[n]c3ccccc3[s]2 Amb22295657 [0,2,0,0,0,0|1,0,1]=4 356 B19R3.202285 CC(CC1CC1)NCc2[n]c3ccccc3[s]2 Amb23978919 [0,0,1,1,0,0|1,0,0]=3 357 B19R3.274609 OC[C@@H]1CCCN1Cc2[n]c3ccccc3[s]2 Amb19481645 [0,0,1,1,0,0|2,0,0]=4 358 B19R3.19192 C(NCC1CCCC1)c2[nH]c3ccccc3[n]2 Amb23953514 [0,0,1,1,0,0|2,0,0]=4 359 B19R3.2370 C(Sc1[n]cc2cccc[n]21)C3CCCCC3 Amb21368170 [0,0,1,1,0,0|2,0,0]=4 360 B17R2.143 O=C(Cc1ccccc1)NC2CCCCC2 Amb1785198 [0,0,1,0,1,0|1,1,0]=4 361 B17R2.143 O=C(Nc1ccccc1)NC2CCCCC2 Amb1195899 [0,0,1,0,1,0|0,1,1]=4 362 B17R2.3569 CCC(CCO)Nc1[nH]c2ccccc2[n]1 Amb23775545 [0,0,1,0,1,0|2,0,0]=4 363 B17R2.3569 CCC(CCO)Nc1[n]c2ccccc2[s]1 Amb23668563 [0,0,1,0,1,0|1,0,0]=3 364 B17R2.3569 CCC(CCO)Nc1[n]c2ccccc2o1 Amb23668580 [0,0,1,0,1,0|1,1,0]=4 365 B17R2.3569 CCC(COC)Nc1[n]c2ccccc2[s]1 Amb23658838 [0,0,1,0,1,0|1,0,0]=3 366 B17R2.3569 COCC(CC)Nc1[n]c2ccccc2o1 Amb23658848 [0,0,1,0,1,0|1,1,0]=4 367 B17R3.8685 C(C1CCCC1)c2[n]c3ccccc3[s]2 Amb24101238 [0,0,0,0,2,0|1,0,0]=3 368 B17R3.8685 C1C=CCC1Nc2[n]c3ccccc3[s]2 Amb23728662 [0,0,0,0,2,0|0,0,2]=4 369 B17R3.8685 C1CCC(C1)Nc2nc3c(o2)cccc3 Amb11277979 [0,0,0,0,2,0|0,1,0]=3 370 B17R3.8685 C1CCCC1=Cc2[n]c3ccccc3[s]2 Amb24101237 [0,0,0,0,2,0|1,0,1]=4 371 B17R3.8685 C1CCN(C1)Sc2nc3c([nH]2)cccc3 Amb10819110 [0,0,0,0,2,0|2,0,0]=4 372 B17R3.8685 C1NCC(C1)Nc2nc3c(s2)cccc3 Amb17515674 [0,0,0,0,2,0|1,0,0]=3 373 B17R3.8685 C1NCCC1Nc2[nH]c3ccccc3[n]2 Amb22272345 [0,0,0,0,2,0|2,0,0]=4 374 B17R3.8685 C1NCCC1Nc2[nH]c3ccccc3[n]2 Amb24772768 [0,0,0,0,2,0|2,0,0]=4 375 B17R3.8685 C1NCCC1Nc2[n]c3ccccc3[s]2 Amb22272346 [0,0,0,0,2,0|1,0,0]=3 376 B17R3.8685 C1NCCC1Nc2[n]c3ccccc3o2 Amb21865295 [0,0,0,0,2,0|1,1,0]=4 377 B17R3.8685 C1NCCC1Nc2[n]c3ccccc3o2 Amb22274209 [0,0,0,0,2,0|1,1,0]=4 378 B17R3.8685 C1NCCC1Oc2[n]c3ccccc3[s]2 Amb22272357 [0,0,0,0,2,0|1,1,0]=4 379 B17R3.8685 C1NCCC1Sc2[nH]c3ccccc3[n]2 Amb22272367 [0,0,0,0,2,0|2,0,0]=4 380 B17R3.8685 C1NCCC1Sc2[nH]c3ccccc3[n]2 Amb22395530 [0,0,0,0,2,0|2,0,0]=4 381 B17R3.8685 C1NCCC1Sc2[n]c3ccccc3[s]2 Amb22272369 [0,0,0,0,2,0|1,0,0]=3 382 B17R3.8685 C1NCCC1Sc2[n]c3ccccc3[s]2 Amb22376702 [0,0,0,0,2,0|1,0,0]=3 383 B17R3.8685 C1NCCC1Sc2[n]c3ccccc3o2 Amb22272368 [0,0,0,0,2,0|1,1,0]=4 384 B17R3.8685 C1NCCC1Sc2[n]c3ccccc3o2 Amb22395526 [0,0,0,0,2,0|1,1,0]=4 385 B17R3.8685 C1NCC[C@@H]1Nc2[nH]c3ccccc3[n]2 Amb22272281 [0,0,0,0,2,0|2,0,0]=4 386 B17R3.8685 C1NCC[C@@H]1Nc2[n]c3ccccc3[s]2 Amb22272283 [0,0,0,0,2,0|1,0,0]=3 387 B17R3.8685 C1NCC[C@@H]1Nc2[n]c3ccccc3o2 Amb22272282 [0,0,0,0,2,0|1,1,0]=4 388 B17R3.8685 C1NCC[C@@H]1Oc2[n]c3ccccc3[s]2 Amb22272293 [0,0,0,0,2,0|1,1,0]=4 389 B17R3.8685 C1NCC[C@@H]1Sc2[nH]c3ccccc3[n]2 Amb22272303 [0,0,0,0,2,0|2,0,0]=4 390 B17R3.8685 C1NCC[C@@H]1Sc2[n]c3ccccc3[s]2 Amb22272305 [0,0,0,0,2,0|1,0,0]=3 391 B17R3.8685 C1NCC[C@@H]1Sc2[n]c3ccccc3o2 Amb22272304 [0,0,0,0,2,0|1,1,0]=4 392 B17R3.8685 C1NCC[C@H]1Nc2[nH]c3ccccc3[n]2 Amb22272309 [0,0,0,0,2,0|2,0,0]=4 393 B17R3.8685 C1NCC[C@H]1Nc2[n]c3ccccc3[s]2 Amb22272311 [0,0,0,0,2,0|1,0,0]=3 394 B17R3.8685 C1NCC[C@H]1Nc2[n]c3ccccc3o2 Amb22272310 [0,0,0,0,2,0|1,1,0]=4 395 B17R3.8685 C1NCC[C@H]1Oc2[n]c3ccccc3[s]2 Amb22272320 [0,0,0,0,2,0|1,1,0]=4 396 B17R3.8685 C1NCC[C@H]1Sc2[nH]c3ccccc3[n]2 Amb22272327 [0,0,0,0,2,0|2,0,0]=4 397 B17R3.8685 C1NCC[C@H]1Sc2[n]c3ccccc3[s]2 Amb22272329 [0,0,0,0,2,0|1,0,0]=3 398 B17R3.8685 C1NCC[C@H]1Sc2[n]c3ccccc3o2 Amb22272328 [0,0,0,0,2,0|1,1,0]=4 399 B17R3.8685 C1OCCC1Nc2[nH]c3ccccc3[n]2 Amb23734342 [0,0,0,0,2,0|2,0,0]=4 400 B17R3.8685 C1OCCC1Nc2[n]c3ccccc3[s]2 Amb23734349 [0,0,0,0,2,0|1,0,0]=3 401 B17R3.8685 C1OCCC1Nc2[n]c3ccccc3o2 Amb23734355 [0,0,0,0,2,0|1,1,0]=4 402 B17R3.8708 C1CC(CCN1)c2[nH]c3ccccc3[n]2 Amb22492332 [0,0,0,0,2,0|2,0,0]=4 403 B17R3.8708 C1CC(CCN1)c2[nH]c3ccccc3[n]2 Amb22741116 [0,0,0,0,2,0|2,0,0]=4 404 B17R3.8708 C1CC(CCN1)c2[n]c3ccccc3o2 Amb22491328 [0,0,0,0,2,0|1,1,0]=4 405 B17R3.8708 C1CC(CCN1)c2[n]c3ccccc3o2 Amb22491329 [0,0,0,0,2,0|1,1,0]=4 406 B17R3.8708 C1CC(CCN1)c2cc3ccccc3[s]2 Amb18169715 [0,0,0,0,2,0|2,0,0]=4 407 B17R3.8708 C1CCC(CN1)c2nc3c([nH]2)cccc3 Amb2578859 [0,0,0,0,2,0|2,0,0]=4 408 B17R3.8708 C1CCC(CN1)c2nc3c(o2)cccc3 Amb1107687 [0,0,0,0,2,0|1,1,0]=4 409 B17R3.8708 C1CCC(CN1)c2nc3c(s2)cccc3 Amb2578986 [0,0,0,0,2,0|1,0,0]=3 410 B17R3.8708 C1CCC(NC1)c2nc3c([nH]2)cccc3 Amb2451231 [0,0,0,0,2,0|2,0,0]=4 411 B17R3.8708 C1CCC(NC1)c2nc3c(o2)cccc3 Amb1107689 [0,0,0,0,2,0|1,1,0]=4 412 B17R3.8708 C1CCC(NC1)c2nc3c(s2)cccc3 Amb1107688 [0,0,0,0,2,0|1,0,0]=3 413 B17R3.8708 C1CCCC=C1c2[n]c3ccccc3[s]2 Amb24069952 [0,0,0,0,2,0|0,0,2]=4 414 B17R3.8708 C1CCCCC1c2[n]c3[n]cccc3o2 Amb18104233 [0,0,0,0,2,0|1,1,0]=4 415 B17R3.8708 C1CCCN(O1)c2[n]c3ccccc3[s]2 Amb23879436 [0,0,0,0,2,0|2,0,0]=4 416 B17R3.8708 C1CCN(CC1)c2nc3c([nH]2)cccc3 Amb1102221 [0,0,0,0,2,0|2,0,0]=4 417 B17R3.8708 C1NCCCC1c2[nH]c3ccccc3[n]2 Amb20242524 [0,0,0,0,2,0|2,0,0]=4 418 B17R3.8708 C1NCCCC1c2cc3ccccc3[s]2 Amb18170394 [0,0,0,0,2,0|2,0,0]=4 419 B17R3.8708 C1OCCOC1c2[n]c3ccccc3[s]2 Amb24069919 [0,0,0,0,2,0|2,0,0]=4 420 B17R3.8708 N1CCC(CC1)c2nc3c(o2)cccc3 Amb1152665 [0,0,0,0,2,0|1,1,0]=4 421 B17R3.8708 N1CCC(CC1)c2nc3c(s2)cccc3 Amb1106971 [0,0,0,0,2,0|1,0,0]=3 422 B17R3.8708 N1CCN(CC1)c2nc3c(s2)cccc3 Amb1287460 [0,0,0,0,2,0|2,0,0]=4 423 B17R3.8708 N1CCN(CC1)c2nc3c(s2)cccc3 Amb13951964 [0,0,0,0,2,0|2,0,0]=4 424 B17R3.8708 O1CCN(CC1)c2nc3c(s2)cccc3 Amb1145733 [0,0,0,0,2,0|2,0,0]=4 425 B19R3.62425 C1SC(=Nc2ccccc21)SCC3CCCO3 Amb20751678 [0,0,0,0,1,1|2,0,0]=4 426 B21R3.2154278 C(CNC1CCCCCC1)c2[nH]c3ccccc3[n]2 Amb18104120 [0,0,0,0,0,2|2,0,0]=4 427 B21R3.2429969 C1CCC(CC1)CCSCc2nc3c([nH]2)cccc3 Amb1156312 [0,0,0,0,0,2|2,0,0]=4 428 B21R3.2429969 C1CCN(CC1)CCCSc2nc3c(s2)cccc3 Amb1286330 [0,0,0,0,0,2|2,0,0]=4 429 B21R3.2429969 C1CCN(CC1)CCCSc2nc3c(s2)cccc3 Amb1350885 [0,0,0,0,0,2|2,0,0]=4 430 B21R3.2429969 C1CCN(CC1)CCCSc2nc3c(s2)cccc3 Amb2468652 [0,0,0,0,0,2|2,0,0]=4