0 B16R2.22304 CC1=CC(=CC(=[N+]1[O-])C)N2CCOCC2 MCULE-5421271319 [0,0,0,0,0,0|4,0,0]=4 1 B16R2.22304 N=C1N=C(C=C(N1O)N)N2CCCCC2 MCULE-7122077029 [0,0,0,0,0,0|0,0,3]=3 2 B16R2.22304 NC1=CC(=NC(=N1=O)N)N2CCCCC2 MCULE-1453254686 [0,0,0,0,0,0|0,0,2]=2 3 B16R2.22304 NC1=CC(=NC(=[N+]1[O-])N)N2CCCCC2 MCULE-5328533745 [0,0,0,0,0,0|0,0,0]=0 4 B15R2.27 CC1=CC(=CC(=C1)N)N2CCCCC2 MCULE-1235405115 [1,0,0,0,0,0|3,0,0]=4 5 B15R2.27 CC1=CC(=NC(=N1)C)N2CCCCC2 MCULE-8147055687 [1,0,0,0,0,0|2,0,1]=4 6 B15R2.27 CC1=CC(=NC(=N1)Cl)N2CCCCC2 MCULE-5244003754 [1,0,0,0,0,0|2,0,1]=4 7 B15R2.27 CC1=CC(=NC(=N1)N)N2CCCCC2 MCULE-8431996421 [1,0,0,0,0,0|1,0,1]=3 8 B15R2.27 CC1=CC(=NC(=N1)N)N2CCNCC2 MCULE-3658346610 [1,0,0,0,0,0|2,0,1]=4 9 B15R2.27 CC1=CC(=NC(=N1)N)N2CCOCC2 MCULE-6366934205 [1,0,0,0,0,0|2,0,1]=4 10 B15R2.27 CC1=NC(=CC(=N1)Cl)N2CCCCC2 MCULE-8963963078 [1,0,0,0,0,0|2,0,1]=4 11 B15R2.27 CC1=NC(=CC(=N1)N)N2CCOCC2 MCULE-3420168349 [1,0,0,0,0,0|2,0,1]=4 12 B15R2.27 CC1=NC(=CC(=N1)N2CCCCC2)N MCULE-9901159109 [1,0,0,0,0,0|1,0,1]=3 13 B15R2.27 CC1=NC(=NC(=C1)N2CCCCC2)C MCULE-8415540753 [1,0,0,0,0,0|2,0,1]=4 14 B15R2.27 ClC1=NC(=NC(=C1)N2CCCCC2)Cl MCULE-6945863467 [1,0,0,0,0,0|2,0,1]=4 15 B15R2.27 NC1=CC(=NC(=C1)N2CCOCC2)Cl MCULE-1036723639 [1,0,0,0,0,0|3,0,0]=4 16 B15R2.27 NC1=CC(=NC(=N1)N2CCCCC2)N MCULE-9481770413 [1,0,0,0,0,0|2,0,0]=3 17 B15R2.27 NC1=CC(=NC(=N1)N2CCOCC2)N MCULE-5476936618 [1,0,0,0,0,0|3,0,0]=4 18 B15R2.27 NC1=CC(=O)NC(=N1)N2CCCCC2 MCULE-6667903139 [1,0,0,0,0,0|3,0,0]=4 19 B15R2.27 NC1=NC(=CC(=C1)Cl)N2CCOCC2 MCULE-7298667842 [1,0,0,0,0,0|3,0,0]=4 20 B15R2.27 NC1=NC(=CC(=N1)Cl)C2CCCCC2 MCULE-5120657511 [1,0,0,0,0,0|2,0,1]=4 21 B15R2.27 NC1=NC(=CC(=N1)Cl)N2CCCCC2 MCULE-3904761458 [1,0,0,0,0,0|1,0,1]=3 22 B15R2.27 NC1=NC(=CC(=N1)N2CCOCC2)Cl MCULE-4758801263 [1,0,0,0,0,0|2,0,1]=4 23 B15R2.27 NC1=NC(=CC(=N1)N2CCOCC2)F MCULE-7279602222 [1,0,0,0,0,0|2,0,1]=4 24 B15R2.27 NC1=NC(=CC(=O)N1)N2CCNCC2 MCULE-5343351712 [1,0,0,0,0,0|2,0,1]=4 25 B15R2.27 NC1=NC(=CC(=O)N1)N2CCNCC2 MCULE-8976881262 [1,0,0,0,0,0|2,0,1]=4 26 B15R2.27 NC1=NC(=CC(=O)N1)N2CCOCC2 MCULE-6270281043 [1,0,0,0,0,0|2,0,1]=4 27 B15R2.27 NC1=NC(=NC(=C1)N2CCCCC2)N MCULE-1494752118 [1,0,0,0,0,0|0,0,1]=2 28 B15R2.27 NC1=NC(=NC(=C1)N2CCOCC2)Cl MCULE-3713524938 [1,0,0,0,0,0|2,0,1]=4 29 B15R2.27 NC1=NC(=NC(=N1)N2CCCCC2)Cl MCULE-8305877486 [1,0,0,0,0,0|2,0,1]=4 30 B15R2.27 NC1=NC(=NC(=N1)N2CCCCC2)N MCULE-4049816091 [1,0,0,0,0,0|1,0,1]=3 31 B15R2.27 NC1=NC(=NC(=N1)S)N2CCCCC2 MCULE-1289953222 [1,0,0,0,0,0|2,0,1]=4 32 B15R2.94 CC1=C(C=CC(=N1)N2CCCCC2)Br MCULE-7996659043 [1,0,0,0,0,0|3,0,0]=4 33 B15R2.94 CC1=CC(=NC=C1Br)N2CCCCC2 MCULE-4256912515 [1,0,0,0,0,0|3,0,0]=4 34 B15R2.94 CC1=CC=C(C=C1N)N2CCCCC2 MCULE-3316817187 [1,0,0,0,0,0|3,0,0]=4 35 B15R2.94 CN1C=NC(=CC1=O)N2CCCCC2 MCULE-4718777986 [1,0,0,0,0,0|2,0,1]=4 36 B15R2.94 NC1=C(C=C(C=C1)N2CCCCC2)N MCULE-9602106948 [1,0,0,0,0,0|3,0,0]=4 37 B15R2.94 NC1=C(C=NC(=N1)N2CCCCC2)F MCULE-5153313811 [1,0,0,0,0,0|3,0,0]=4 38 B15R2.94 NC1=CC(=NC=C1I)N2CCOCC2 MCULE-9258235799 [1,0,0,0,0,0|3,0,0]=4 39 B15R2.13164 NC1=NC(=CC(=[N+]1[O-])N)N2CCCC2 MCULE-6958618637 [0,0,0,0,1,0|0,0,0]=1 40 B14R2.21 BrC1=CC(=NC=C1)N2CCCCC2 MCULE-9884002149 [2,0,0,0,0,0|2,0,0]=4 41 B14R2.21 BrC1=CC=CC(=N1)N2CCCCC2 MCULE-6795606267 [2,0,0,0,0,0|2,0,0]=4 42 B14R2.21 ClC1=CC(=NC=C1)N2CCCCC2 MCULE-9413705494 [2,0,0,0,0,0|2,0,0]=4 43 B14R2.21 ClC1=NC(=CC=C1)N2CCCCC2 MCULE-1403142779 [2,0,0,0,0,0|2,0,0]=4 44 B14R2.21 ClC1=NC=CC(=N1)N2CCCCC2 MCULE-3416872431 [2,0,0,0,0,0|1,0,1]=4 45 B14R2.21 ClC1=NC=NC(=C1)N2CCCCC2 MCULE-9952732325 [2,0,0,0,0,0|1,0,1]=4 46 B14R2.21 FC1=NC(=CC=C1)N2CCCCC2 MCULE-2002646849 [2,0,0,0,0,0|2,0,0]=4 47 B14R2.21 IC1=CC(=NC=C1)N2CCCCC2 MCULE-2260945175 [2,0,0,0,0,0|2,0,0]=4 48 B14R2.21 NC1=CC(=CC=C1)N2CCCCC2 MCULE-6282091645 [2,0,0,0,0,0|2,0,0]=4 49 B14R2.21 NC1=CC(=NC=C1)N2CCNCC2 MCULE-2594585192 [2,0,0,0,0,0|2,0,0]=4 50 B14R2.21 NC1=CC(=NC=C1)N2CCNCC2 MCULE-8885559332 [2,0,0,0,0,0|2,0,0]=4 51 B14R2.21 NC1=CC(=NC=N1)N2CCNCC2 MCULE-4853723991 [2,0,0,0,0,0|1,0,1]=4 52 B14R2.21 NC1=CC=CC(=C1)N2CCCCC2 MCULE-7161026194 [2,0,0,0,0,0|2,0,0]=4 53 B14R2.21 NC1=CC=CC(=N1)N2CCCCC2 MCULE-4954669809 [2,0,0,0,0,0|1,0,0]=3 54 B14R2.21 NC1=CC=CC(=N1)N2CCCCC2 MCULE-6783957480 [2,0,0,0,0,0|1,0,0]=3 55 B14R2.21 NC1=CC=CC(=N1)N2CCOCC2 MCULE-9263072981 [2,0,0,0,0,0|2,0,0]=4 56 B14R2.21 NC1=CC=NC(=C1)N2CCCCC2 MCULE-8717872691 [2,0,0,0,0,0|1,0,0]=3 57 B14R2.21 NC1=CC=NC(=C1)N2CCOCC2 MCULE-9718574696 [2,0,0,0,0,0|2,0,0]=4 58 B14R2.21 NC1=NC(=CC=N1)N2CCCCC2 MCULE-4778755058 [2,0,0,0,0,0|0,0,1]=3 59 B14R2.21 NC1=NC(=CC=N1)N2CCNCC2 MCULE-1404500761 [2,0,0,0,0,0|1,0,1]=4 60 B14R2.21 NC1=NC=CC(=C1)N2CCCCC2 MCULE-6326716839 [2,0,0,0,0,0|1,0,1]=4 61 B14R2.21 NC1=NC=CC(=N1)N2CCOCC2 MCULE-1591193588 [2,0,0,0,0,0|1,0,1]=4 62 B14R2.21 NC1=NC=NC(=C1)N2CCCCC2 MCULE-9699721401 [2,0,0,0,0,0|0,0,1]=3 63 B14R2.21 NC1=NC=NC(=C1)N2CCNCC2 MCULE-7892789936 [2,0,0,0,0,0|1,0,1]=4 64 B14R2.21 NC1=NC=NC(=C1)N2CCOCC2 MCULE-5225732357 [2,0,0,0,0,0|1,0,1]=4 65 B14R2.21 NC1=NC=NC(=N1)N2CCCCC2 MCULE-7254770972 [2,0,0,0,0,0|1,0,1]=4 66 B14R2.21 O=C1C=C(N=CN1)N2CCCCC2 MCULE-2431974718 [2,0,0,0,0,0|1,0,1]=4 67 B14R2.21 S=C1C=C(N=CN1)N2CCCCC2 MCULE-4814246669 [2,0,0,0,0,0|1,0,1]=4 68 B14R2.68 BrC1=CN=C(C=C1)N2CCCCC2 MCULE-1962955978 [2,0,0,0,0,0|2,0,0]=4 69 B14R2.68 BrC1=CN=C(C=C1)N2CCCCC2 MCULE-7023732499 [2,0,0,0,0,0|2,0,0]=4 70 B14R2.68 C[N+]1=CC=C(C=C1)N2CCCCC2 MCULE-9234489975 [2,0,0,0,0,0|2,0,0]=4 71 B14R2.68 C[N+]1=CC=C(C=C1)N2CCCCC2 MCULE-9305668991 [2,0,0,0,0,0|2,0,0]=4 72 B14R2.68 ClC1=CN=C(C=C1)N2CCCCC2 MCULE-5432258217 [2,0,0,0,0,0|2,0,0]=4 73 B14R2.68 FC1=CN=C(C=C1)N2CCCCC2 MCULE-1383150506 [2,0,0,0,0,0|2,0,0]=4 74 B14R2.68 NC1=CC=C(N=C1)N2CCCCC2 MCULE-5860896383 [2,0,0,0,0,0|2,0,0]=4 75 B14R2.68 NC1=CN=C(C=C1)N2CCCCC2 MCULE-3566954710 [2,0,0,0,0,0|2,0,0]=4 76 B14R2.68 NC1=CN=C(C=C1)N2CCCCC2 MCULE-5004622056 [2,0,0,0,0,0|2,0,0]=4 77 B14R2.68 NC1=CN=C(C=C1)N2CCCCC2 MCULE-5983364348 [2,0,0,0,0,0|2,0,0]=4 78 B16R2.79341 CC1=CC(=NC(=N1)N)N2CCC(CC2)C MCULE-7324626449 [1,1,0,0,0,0|1,0,1]=4 79 B16R2.79341 CN1CCN(CC1)C2=CC(=NC(=N2)N)N MCULE-3396242079 [1,1,0,0,0,0|1,0,1]=4 80 B16R2.79341 NC1=NC(=CC(=N1)N2CCC(CC2)O)Cl MCULE-7016055668 [1,1,0,0,0,0|1,0,1]=4 81 B16R2.79341 NC1=NC(=CC(=O)N1)N2CCC(CC2)N MCULE-7308869842 [1,1,0,0,0,0|1,0,1]=4 82 B16R2.79341 NC1=NC(=CC(=O)N1)N2CCC(CC2)N MCULE-7357668280 [1,1,0,0,0,0|1,0,1]=4 83 B16R2.80704 CC1CCCN(C1)C2=NC(=NC(=C2)Cl)N MCULE-5810345069 [1,1,0,0,0,0|1,0,1]=4 84 B16R2.80704 NC1=NC(=CC(=N1)Cl)N2CCCC(C2)O MCULE-7473750213 [1,1,0,0,0,0|1,0,1]=4 85 B16R2.80704 NC1=NC(=CC(=O)N1)N2CCCC(C2)N MCULE-8717439280 [1,1,0,0,0,0|1,0,1]=4 86 B16R2.80704 NC1=NC(=CC(=O)N1)N2CCCC(C2)N MCULE-9543383044 [1,1,0,0,0,0|1,0,1]=4 87 B16R2.95959 CC1CCCCN1C2=NC(=NC(=C2)Cl)N MCULE-6586946228 [1,1,0,0,0,0|1,0,1]=4 88 B14R2.249 NC1=CC(=NC(=N1)N2CCCC2)N MCULE-7396505944 [1,0,0,0,1,0|2,0,0]=4 89 B14R2.249 NC1=NC(=CC(=N1)N2CCCC2)Cl MCULE-3382218424 [1,0,0,0,1,0|1,0,1]=4 90 B14R2.249 NC1=NC(=NC(=N1)N2CCCC2)N MCULE-2354111178 [1,0,0,0,1,0|1,0,1]=4 91 B14R2.70 NC1=C(C=C(N=C1)N2CCCC2)N MCULE-9429102660 [1,0,0,0,1,0|2,0,0]=4 92 B16R2.11343 NC1=NC(=CC(=N1)N2CCCCCC2)F MCULE-2781956401 [1,0,0,0,0,1|1,0,1]=4