0 B7R0.3 CCC(=O)NCCN 4028425 [1,0,0,0,0,0|2,0,0]=3 1 B7R0.3 CCN(C)CCNC 4027628 [1,0,0,0,0,0|3,0,0]=4 2 B7R0.3 CNC(=O)CCCN 4089383 [1,0,0,0,0,0|2,0,0]=3 3 B7R0.3 CNCCC(=O)NC 4088709 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.1 CCC1CCC(N)CC1 3018386 [0,0,0,1,0,0|1,0,1]=3 5 B9R1.1 CN1CCC(CCl)CC1 4090733 [0,0,0,1,0,0|3,0,0]=4 6 B9R1.1 COC1CCC(N)CC1 4100479 [0,0,0,1,0,0|2,0,1]=4 7 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 4048378 [0,0,0,1,0,0|2,0,1]=4 8 B9R1.1 CO[C@H]1CC[C@H](N)CC1 4087947 [0,0,0,1,0,0|2,0,1]=4 9 B9R1.5 N[C@@H]1CCCCC[C@@H]1O 4046958 [0,0,0,1,0,0|1,0,2]=4 10 B9R1.7 N#CCC1CCC(=O)N1 4108168 [0,0,0,1,0,0|2,0,1]=4 11 B9R1.7 N#CC[C@@H]1CCC(=O)N1 4046620 [0,0,0,1,0,0|2,0,1]=4 12 B9R1.7 NCCC1CCC(=O)N1 4110733 [0,0,0,1,0,0|2,0,0]=3 13 B9R1.7 O=C1CC[C@@H](CCO)N1 4046046 [0,0,0,1,0,0|2,0,0]=3 14 B9R1.7 O=C1CC[C@H](CCO)N1 4054374 [0,0,0,1,0,0|2,0,0]=3 15 B9R1.11 CNC(=O)C1CCCN1 4018265 [0,0,0,1,0,0|2,0,0]=3 16 B9R1.11 CNC(=O)C1CCNC1 4029785 [0,0,0,1,0,0|2,0,0]=3 17 B9R1.11 CNC(=O)[C@@H]1CCCN1 4088702 [0,0,0,1,0,0|2,0,0]=3 18 B9R1.11 CNC(=O)[C@H]1CCCN1 4090109 [0,0,0,1,0,0|2,0,0]=3 19 B9R1.11 NCC(=O)N1CCCC1 4088472 [0,0,0,1,0,0|2,0,0]=3 20 B9R1.49 CC1CNC(=O)CCN1 4089332 [0,0,0,1,0,0|2,0,0]=3 21 B9R1.49 NC1CCNC(=O)CC1 4020296 [0,0,0,1,0,0|2,0,0]=3 22 B9R1.89 CNC1CCCCCC1 4089903 [0,0,0,1,0,0|2,0,1]=4 23 B9R1.118 CCC1(N)CCOCC1 4017685 [0,0,0,1,0,0|2,0,1]=4 24 B9R1.118 CC[C@]1(C)CCCNC1 4018894 [0,0,0,1,0,0|2,0,1]=4 25 B9R1.132 CN1C(=O)CCC1CN 4088603 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.132 CN1C(=O)CCC1CN 4111538 [0,0,0,1,0,0|2,0,0]=3 27 B6R0.6 C=CCNCCC 4088685 [2,0,0,0,0,0|1,0,1]=4 28 B6R0.6 CCOCCNC 4089681 [2,0,0,0,0,0|2,0,0]=4 29 B6R0.4 CCCCC(=N)N 4090419 [2,0,0,0,0,0|2,0,0]=4 30 B6R0.4 CNCCC(=O)O 4088781 [2,0,0,0,0,0|2,0,0]=4 31 B6R0.4 CNCCC(N)=O 4090391 [2,0,0,0,0,0|2,0,0]=4 32 B8R0.3 COC(=O)[C@@H](N)CSC 4090948 [1,1,0,0,0,0|2,0,0]=4 33 B8R0.8 CC(C)C(=O)NCCN 4090894 [1,1,0,0,0,0|2,0,0]=4 34 B8R0.8 CN(C)C(=O)CCCN 4089531 [1,1,0,0,0,0|2,0,0]=4 35 B8R0.8 CNCCC(=O)N(C)C 4034649 [1,1,0,0,0,0|2,0,0]=4 36 B8R0.25 CCS(=O)(=O)CCNC 4090716 [1,1,0,0,0,0|2,0,0]=4 37 B10R0.2 CCCC(N)CC(=O)OCC 4090675 [0,2,0,0,0,0|0,0,0]=2 38 B8R1.2 CNC1CCSCC1 4090591 [1,0,0,1,0,0|2,0,0]=4 39 B8R1.2 NCC1=CCCCC1 4089848 [1,0,0,1,0,0|1,0,1]=4 40 B8R1.5 C[C@@H]1NCCN[C@H]1C 4036451 [1,0,0,1,0,0|2,0,0]=4 41 B8R1.8 CCNC1CCCC1 4088683 [1,0,0,1,0,0|1,0,0]=3 42 B8R1.8 CCOC1CCNC1 4089420 [1,0,0,1,0,0|2,0,0]=4 43 B8R1.8 CNCC1CCCC1 4089391 [1,0,0,1,0,0|1,0,1]=4 44 B8R1.11 CC[C@H]1CCC[C@H]1N 4015651 [1,0,0,1,0,0|1,0,1]=4 45 B8R1.22 CC1CNCCCO1 4041125 [1,0,0,1,0,0|2,0,0]=4 46 B8R1.22 OC1CCCNCC1 4088463 [1,0,0,1,0,0|2,0,0]=4 47 B8R1.1 CCC1CCC(=O)N1 4027451 [1,0,0,1,0,0|1,0,0]=3 48 B8R1.1 CCC1CNC(=O)C1 4026756 [1,0,0,1,0,0|1,0,0]=3 49 B8R1.1 NCC1CCC(=O)N1 4111537 [1,0,0,1,0,0|2,0,0]=4 50 B8R1.1 O=C1CCC(CCl)O1 4035082 [1,0,0,1,0,0|2,0,0]=4 51 B8R1.3 CC1CCC(N)CC1 3002871 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.3 CC1CNC(=O)CN1 4045852 [1,0,0,1,0,0|2,0,0]=4 53 B8R1.3 C[C@@H]1CNC(=O)CN1 4090663 [1,0,0,1,0,0|2,0,0]=4 54 B8R1.3 C[C@H]1CC[C@@H](N)CC1 4095854 [1,0,0,1,0,0|1,0,1]=4 55 B8R1.3 C[C@H]1CNC(=O)CN1 4089619 [1,0,0,1,0,0|2,0,0]=4 56 B8R1.3 N[C@H]1CCC(=O)NC1 4097106 [1,0,0,1,0,0|2,0,0]=4 57 B8R1.40 NCC(=O)NC1CC1 4088865 [1,0,0,1,0,0|2,0,0]=4 58 B8R1.4 CC1CNCC(=O)N1 4049339 [1,0,0,1,0,0|2,0,0]=4 59 B8R1.4 C[C@H]1CNCC(=O)N1 4057204 [1,0,0,1,0,0|2,0,0]=4 60 B8R1.7 CC(N)C1CCCC1 4090794 [1,0,0,1,0,0|1,0,1]=4 61 B8R1.72 CC1(N)CCCCC1 4090363 [1,0,0,1,0,0|1,0,1]=4 62 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 4039321 [0,1,0,1,0,0|2,0,0]=4 63 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 4089275 [0,1,0,1,0,0|2,0,0]=4 64 B10R1.79 N[C@H]1CCC[C@@H](O)CCC1 4012467 [0,1,0,1,0,0|0,0,2]=4 65 B10R1.79 N[C@H]1CCC[C@H](O)CCC1 4074884 [0,1,0,1,0,0|0,0,2]=4 66 B10R1.11 CNCC(=O)N1CCCC1 3020358 [0,1,0,1,0,0|1,0,0]=3 67 B10R1.15 CNC(=O)C1CCCCN1 4088672 [0,1,0,1,0,0|1,0,0]=3 68 B10R1.15 CNC(=O)C1CCCNC1 4090914 [0,1,0,1,0,0|1,0,0]=3 69 B10R1.15 COC(=O)C1CNCCO1 4088946 [0,1,0,1,0,0|2,0,0]=4 70 B10R1.15 COC(=O)[C@@H]1CNCCO1 4098226 [0,1,0,1,0,0|2,0,0]=4 71 B10R1.176 CN1CC(CBr)CCC1=O 4065972 [0,1,0,1,0,0|2,0,0]=4 72 B10R1.411 COC(=O)[C@@]1(C)CCCN1 4042235 [0,1,0,1,0,0|2,0,0]=4 73 B10R1.26 NCC1CCS(=O)(=O)CC1 4090875 [0,1,0,1,0,0|2,0,0]=4 74 B10R1.95 NCCC1CCS(=O)(=O)C1 4041197 [0,1,0,1,0,0|2,0,0]=4 75 B10R1.95 NCCC1CCS(=O)(=O)C1 4091131 [0,1,0,1,0,0|2,0,0]=4 76 B10R1.27 O=C(CCl)NC1CCCC1 3005203 [0,1,0,1,0,0|1,0,0]=3 77 B10R1.23 CN(C)C(=O)C1CCCN1 4018266 [0,1,0,1,0,0|2,0,0]=4 78 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 4079863 [0,1,0,1,0,0|2,0,0]=4 79 B10R2.2 O=C1C[C@H]2CNC[C@H]2N1 4110412 [0,0,0,2,0,0|2,0,0]=4 80 B10R2.14 O=C1CC(C2CC2)CN1 4048224 [0,0,0,2,0,0|1,0,0]=3 81 B10R2.32 N[C@H]1CC[C@@H]2CCC[C@H]12 4039571 [0,0,0,2,0,0|1,0,1]=4 82 B10R2.32 N[C@H]1CC[C@H]2CCC[C@@H]12 4080727 [0,0,0,2,0,0|1,0,1]=4 83 B10R2.332 O=C1CC2(CCC2)CN1 4110780 [0,0,0,2,0,0|1,0,0]=3