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C[S+](CC[C@@H](N)C(=O)[O-])C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C(N=CN=C23)N MCULE-7198293915 [0,1,0,0,0,0|0,0,2]=3 17 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H](C([C@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-3908284543 [0,1,0,0,0,0|0,0,1]=2 18 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H](C([C@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-8100589153 [0,1,0,0,0,0|0,0,1]=2 19 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-1282771149 [0,1,0,0,0,0|0,0,1]=2 20 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-2667468526 [0,1,0,0,0,0|0,0,1]=2 21 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-3617489926 [0,1,0,0,0,0|0,0,1]=2 22 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-4543939489 [0,1,0,0,0,0|0,0,1]=2 23 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-4617348994 [0,1,0,0,0,0|0,0,1]=2 24 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-6135241011 [0,1,0,0,0,0|0,0,1]=2 25 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-7013421597 [0,1,0,0,0,0|0,0,1]=2 26 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)O)C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-7209881658 [0,1,0,0,0,0|0,0,1]=2 27 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)[O-])C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C(N=CN=C23)N MCULE-4080715104 [0,1,0,0,0,0|0,0,2]=3 28 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)[O-])C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-5116294085 [0,1,0,0,0,0|0,0,2]=3 29 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)[O-])C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C2N=CN=C3N MCULE-6567909931 [0,1,0,0,0,0|0,0,2]=3 30 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)[O-])C[C@H]1O[C@H]([C@H](C1O)O)N2C=NC3=C(N=CN=C23)N MCULE-2472176935 [0,1,0,0,0,0|0,0,2]=3 31 B29R3.4027832531 C[S+](CC[C@H](N)C(=O)[O-])C[C@H]1O[C@H]([C@H](C1O)O)N2C=NC3=C(N=CN=C23)N MCULE-4832063235 [0,1,0,0,0,0|0,0,2]=3 32 B29R3.4027832531 C[Se+](CCC(N)C(=O)[O-])C[C@H]1O[C@H]([C@@H]([C@@H]1O)O)N2C=NC3=C(N=CN=C23)N MCULE-1241389912 [0,1,0,0,0,0|0,1,1]=3 33 B29R3.4027832531 NC1=C2N=CN(C2=NC=N1)C3OC(C(C3O)O)CC(N)CCC(N)C(=O)O MCULE-5701898177 [0,1,0,0,0,0|1,0,0]=2 34 B29R3.4027832531 NC1=C2N=CN(C2=NC=N1)[C@@H]3OC(=C[C@@H](N)CC[C@@H](N)C(=O)O)[C@@H]([C@@H]3O)O MCULE-6412489647 [0,1,0,0,0,0|1,0,2]=4 35 B29R3.4027832531 NC1=C2N=CN(C2=NC=N1)[C@@H]3O[C@@H]([C@H]([C@H]3O)O)C[C@@H](N)CC[C@H](N)C(=O)O MCULE-2982853083 [0,1,0,0,0,0|1,0,0]=2 36 B29R3.4027832531 NC1=C2N=CN(C2=NC=N1)[C@@H]3O[C@@H]([C@H]([C@H]3O)O)C[C@@H](N)CC[C@H](N)C(=O)O MCULE-3511984913 [0,1,0,0,0,0|1,0,0]=2 37 B29R3.4027832531 NC1=NC=NC2=C1N=CN2[C@@H]3O[C@@H]([C@H]([C@H]3O)O)CS(=O)CC[C@H](N)C(=O)O MCULE-3791700771 [0,1,0,0,0,0|0,0,1]=2 38 B27R3.254419871 NC1=C2N=CN(C2=NC=N1)C3OC(C(C3O)O)CSCC(N)C(=O)O MCULE-8629782405 [0,0,0,0,1,0|0,0,0]=1 39 B28R3.2214111265 NC1=C2N=CN(C2=NC=N1)[C@@H]3O[C@@H]([C@H]([C@H]3O)O)[C@@H](S)CCC(N)C(=O)O MCULE-6394196131 [0,1,0,0,1,0|0,0,0]=2 40 B30R3.10382648784 NC1=C2N=CN(C2=NC=N1)[C@@H]3O[C@@H]([C@H]([C@H]3O)O)CS(=O)(=O)CC[C@H](N)C(=O)O MCULE-9294664137 [0,2,0,0,0,0|0,0,1]=3 41 B30R3.10382648784 NC1=NC=NC2=C1N=CN2[C@H]3O[C@@H]([C@H]([C@H]3O)O)CS(=O)(=O)CCC(N)C(=O)O MCULE-2941067557 [0,2,0,0,0,0|0,0,1]=3 42 B30R3.10382648784 [C@H]1(O[C@@H]([C@H]([C@H]1O)O)CS(=O)(=O)CC[C@H](N)C(=O)O)N2C=NC3=C(N=CN=C23)N MCULE-3659528803 [0,2,0,0,0,0|0,0,1]=3 43 B30R3.19045344662 N#CC1=CN(C2=NC=NC(=C12)N)C3O[C@@H]([C@H]([C@H]3O)O)CSCC[C@@H](N)C(=O)O MCULE-2398804699 [0,2,0,0,0,0|1,0,0]=3