0 B5R0.3 CC(CN)CO 4036254 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 CC[C@@H](O)CN 4036900 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.3 CC\C(N)=N\O 4030035 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.3 CC\C(N)=N\O 4089717 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.3 CNC(=O)CBr 4023689 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.3 CNC(=O)CCl 4031514 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.3 CNC(=O)CN 4030580 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.3 CNC(=O)CO 4032781 [0,0,0,0,0,0|2,0,0]=2 8 B5R0.3 CNC(C)CO 4028640 [0,0,0,0,0,0|3,0,1]=4 9 B5R0.3 COC(C)CO 4045600 [0,0,0,0,0,0|3,0,1]=4 10 B5R0.3 N\C(CO)=N/O 4045643 [0,0,0,0,0,0|2,0,0]=2 11 B4R0.1 CC(=O)CN 4035253 [1,0,0,0,0,0|1,0,0]=2 12 B4R0.1 CCC(=N)N 4012617 [1,0,0,0,0,0|3,0,0]=4 13 B4R0.1 CCC(=N)N 4090083 [1,0,0,0,0,0|3,0,0]=4 14 B4R0.1 N=C(N)CF 4028912 [1,0,0,0,0,0|3,0,0]=4 15 B4R0.2 C=C=CCN 4085485 [1,0,0,0,0,0|2,0,1]=4 16 B6R0.1 CCCC(=O)NN 3002586 [0,1,0,0,0,0|3,0,0]=4 17 B6R0.1 CCC\C(N)=N\O 4030621 [0,1,0,0,0,0|3,0,0]=4 18 B6R0.1 CCC\C(N)=N\O 4089955 [0,1,0,0,0,0|3,0,0]=4 19 B6R0.1 CCNC(=O)CBr 4023688 [0,1,0,0,0,0|2,0,0]=3 20 B6R0.1 CCNC(C)CO 4027506 [0,1,0,0,0,0|2,0,1]=4 21 B6R0.1 CNC(=O)CCCl 4027989 [0,1,0,0,0,0|3,0,0]=4 22 B6R0.1 CNC(=O)CCO 4035059 [0,1,0,0,0,0|2,0,0]=3 23 B6R0.1 CNCC(=O)NC 4033340 [0,1,0,0,0,0|3,0,0]=4 24 B6R0.1 COC(=O)CCO 4041011 [0,1,0,0,0,0|2,0,0]=3 25 B6R0.1 COCC(N)CO 4030437 [0,1,0,0,0,0|1,0,1]=3 26 B6R0.1 COCC(O)CN 4001723 [0,1,0,0,0,0|1,0,2]=4 27 B6R0.1 COC\C(N)=N\O 4043775 [0,1,0,0,0,0|2,0,0]=3 28 B6R0.1 CSC\C(N)=N\O 4042689 [0,1,0,0,0,0|2,1,0]=4 29 B6R0.1 N\C(CCO)=N/O 4044130 [0,1,0,0,0,0|2,0,0]=3 30 B6R0.3 CC(C)C(=O)NN 3015435 [0,1,0,0,0,0|3,0,0]=4 31 B6R0.3 CC(C)\C(N)=N\O 4031815 [0,1,0,0,0,0|3,0,0]=4 32 B6R0.3 CC(O)C(=N)NO 4041720 [0,1,0,0,0,0|2,0,0]=3 33 B6R0.3 CN(C)C(=O)CN 4029380 [0,1,0,0,0,0|3,0,0]=4 34 B6R0.3 CN(C)C(=O)CO 4033769 [0,1,0,0,0,0|2,0,0]=3 35 B6R0.3 CNC(=O)C(C)Cl 4026929 [0,1,0,0,0,0|3,0,0]=4 36 B6R0.3 CNC(=O)C(C)N 4033710 [0,1,0,0,0,0|3,0,0]=4 37 B6R1.2 CC1CNOC1 4040895 [0,0,0,1,0,0|2,0,1]=4 38 B6R1.2 NC1CCOC1 4003522 [0,0,0,1,0,0|2,0,1]=4 39 B6R1.2 OC1CNOC1 4044152 [0,0,0,1,0,0|1,0,2]=4 40 B5R0.1 C#CCC(=O)O 4035749 [1,1,0,0,0,0|1,0,0]=3 41 B5R0.1 C=C(C)CNN 4045392 [1,1,0,0,0,0|2,0,0]=4 42 B5R0.1 CC(N)CCO 4027026 [1,1,0,0,0,0|1,0,1]=4 43 B5R0.1 COCC(=N)N 4018503 [1,1,0,0,0,0|2,0,0]=4 44 B5R0.1 NC(=O)CCO 4070037 [1,1,0,0,0,0|1,0,0]=3 45 B5R0.1 NCCC(N)=O 4034723 [1,1,0,0,0,0|2,0,0]=4 46 B5R0.5 CC(O)C(=N)N 4048497 [1,1,0,0,0,0|2,0,0]=4 47 B5R0.2 NNCCCO 4085333 [1,1,0,0,0,0|1,0,1]=4 48 B7R0.2 CC(C)NC(=O)CBr 4023681 [0,2,0,0,0,0|2,0,0]=4 49 B7R0.2 CC(C)NC(=O)CN 4030242 [0,2,0,0,0,0|2,0,0]=4 50 B7R0.2 CC(C)NC(=O)CN 4091078 [0,2,0,0,0,0|2,0,0]=4 51 B7R0.2 CC(O)CC(=O)NN 3015526 [0,2,0,0,0,0|2,0,0]=4 52 B7R0.2 CNC(=O)CC(=O)O 4027258 [0,2,0,0,0,0|2,0,0]=4 53 B7R0.3 CCC(=O)NCCN 4110359 [0,2,0,0,0,0|2,0,0]=4 54 B7R0.3 CCOCC(=O)NN 4024074 [0,2,0,0,0,0|2,0,0]=4 55 B7R0.3 CCOCC(=O)NN 4089996 [0,2,0,0,0,0|2,0,0]=4 56 B7R0.3 COCC\C(N)=N/O 4035623 [0,2,0,0,0,0|2,0,0]=4 57 B7R0.5 CCNC(=O)C(C)Cl 4028638 [0,2,0,0,0,0|2,0,0]=4 58 B7R0.5 CN(C)C(=O)CCO 4035245 [0,2,0,0,0,0|2,0,0]=4 59 B7R0.7 CCNC(=O)CCCl 4027744 [0,2,0,0,0,0|2,0,0]=4 60 B7R0.7 CCOC(=O)CCO 4040900 [0,2,0,0,0,0|1,0,0]=3 61 B7R0.10 CCC(N)C(=O)NO 4045655 [0,2,0,0,0,0|2,0,0]=4 62 B7R0.10 CCN(C)C(=O)CCl 4027839 [0,2,0,0,0,0|2,0,0]=4 63 B7R0.10 COC(C)C(=O)NN 4024075 [0,2,0,0,0,0|2,0,0]=4 64 B7R0.10 COC(C)\C(N)=N/O 4045625 [0,2,0,0,0,0|2,0,0]=4 65 B7R0.14 CC(C)(C)C(=O)CN 4030730 [0,2,0,0,0,0|2,0,0]=4 66 B7R0.16 CC(O)C(=O)N(C)C 4035486 [0,2,0,0,0,0|2,0,0]=4 67 B5R1.1 C1CNOC1 4013261 [1,0,0,1,0,0|1,0,1]=4 68 B7R1.3 O=C1CCCSC1 4021743 [0,1,0,1,0,0|1,1,0]=4 69 B7R1.3 O=C1CNCCN1 4102110 [0,1,0,1,0,0|2,0,0]=4 70 B7R1.4 NC1CCNC1=O 4110613 [0,1,0,1,0,0|2,0,0]=4 71 B7R1.4 N[C@H]1COC[C@@H]1O 4034126 [0,1,0,1,0,0|1,0,1]=4