0 B35R3.2202630712 CN(Cc1c[n]c2[n]c(N)[n]c(N)c2[n]1)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C([O-])=O Amb22745620 [0,0,0,0,0,0|0,0,1]=1 1 B35R3.2202630712 CN(Cc1c[n]c2[n]c(N)[n]c(N)c2[n]1)c3ccc(cc3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O Amb22168103 [0,0,0,0,0,0|0,0,2]=2 2 B35R3.2202630712 CN(Cc1cc2c(cc1)N=C(N)NC2=O)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O Amb22444216 [0,0,0,0,0,0|3,0,1]=4 3 B35R3.2202630712 CN(Cc1cnc2nc(N)nc(N)c2n1)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O Amb17943043 [0,0,0,0,0,0|0,0,0]=0 4 B35R3.2202630712 OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)N(Cc2cnc3c(n2)c(N)nc(n3)N)C Amb10807679 [0,0,0,0,0,0|0,0,0]=0 5 B34R3.3454851072 N=C1Nc2[n]cc(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)[n]c2C(O)=N1 Amb22166863 [1,0,0,0,0,0|1,0,2]=4 6 B34R3.3454851072 NC1=NC(=O)C2=NC(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)=CNC2=N1 Amb21933575 [1,0,0,0,0,0|1,0,1]=3 7 B34R3.3454851072 NC1=NC(=O)C2=NC(CNc3ccc(cc3)C(=O)N[13CH]([13CH2][13CH2][13C](O)=O)[13C](O)=O)=CNC2=N1 Amb19132380 [1,0,0,0,0,0|1,0,1]=3 8 B34R3.3454851072 NC1=NC(=O)C2=NC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=CNC2=N1 Amb19132378 [1,0,0,0,0,0|1,0,1]=3 9 B34R3.3454851072 NC1=NC(=O)C2=NC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=CNC2=N1 Amb24273733 [1,0,0,0,0,0|1,0,1]=3 10 B34R3.3454851072 NC=1NC(=O)c2[n]c(CNc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c[n]c2N1 Amb21929343 [1,0,0,0,0,0|1,0,1]=3 11 B34R3.3454851072 NC=1NC(=O)c2[n]c(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)c[n]c2N1 Amb21855753 [1,0,0,0,0,0|1,0,1]=3 12 B34R3.3454851072 NC=1Nc2[n]cc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[n]c2C(=O)N1 Amb18511448 [1,0,0,0,0,0|1,0,1]=3 13 B34R3.3454851072 NC=1Nc2[n]cc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[n]c2C(=O)N1 Amb20240655 [1,0,0,0,0,0|1,0,1]=3 14 B34R3.3454851072 Nc1[n]c2[n]cc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[n]c2c(N)[n]1 Amb22336651 [1,0,0,0,0,0|0,0,0]=1 15 B34R3.3454851072 Nc1[n]c2[n]cc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[n]c2c(O)[n]1 Amb22347802 [1,0,0,0,0,0|1,0,0]=2 16 B34R3.3454851072 OC(=O)CC[C@H](C(=O)O)NC(=O)c1ccc(cc1)NCc2cnc3c(n2)c(N)nc(n3)N Amb10072241 [1,0,0,0,0,0|0,0,0]=1 17 B36R3.5678906955 CN(Cc1cnc2nc(N)[nH]c(=O)c2n1)c3ccc(cc3)C(=O)N[C@@H](CC(N)C(O)=O)C(O)=O Amb17943027 [0,1,0,0,0,0|1,0,1]=3 18 B36R3.12284678226 OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)N(Cc2nc3c(N)nc(nc3nc2O)N)C Amb17615485 [0,1,0,0,0,0|0,0,0]=1 19 B36R3.12410965296 CC(Cc1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O)Cc2c[n]c3NC(N)=NC(=O)c3[n]2 Amb24088177 [0,0,0,0,0,1|2,0,1]=4 20 B35R3.2202634410 C=C(CC(NC(=O)c1ccc(CCc2c[n]c3[n]c(N)[n]c(N)c3[n]2)cc1)C(O)=O)C(O)=O Amb22479722 [1,1,0,0,0,0|1,0,1]=4 21 B35R3.2202634410 C=C(C[C@H](NC(=O)c1ccc(CCc2c[n]c3[n]c(N)[n]c(N)c3[n]2)cc1)C(O)=O)C(O)=O Amb24088180 [1,1,0,0,0,0|1,0,1]=4 22 B37R3.2759604796 COC(=O)C(NC(=O)c1ccc(cc1)N(Cc2cnc3c(n2)c(N)nc(n3)N)C)CCC(=O)OC Amb17616902 [0,2,0,0,0,0|0,0,0]=2 23 B37R3.3036549860 C#CCC(Cc1c[n]c2[n]c(N)[n]c(N)c2[n]1)c3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O Amb22755684 [0,2,0,0,0,0|1,0,0]=3 24 B33R3.846643283 NC=1NC(=O)c2[n]c(Cc3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)c[n]c2N1 Amb22478609 [1,0,0,0,1,0|1,0,1]=4