0 B21R2.4469091 CC(C)CCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-6457605052 [0,0,0,0,0,0|1,0,0]=1 1 B21R2.4469091 CN(C)CCNC(=O)C1=C(C2=C(C=CC=C2)NC1=O)O MCULE-2238573832 [0,0,0,0,0,0|0,0,4]=4 2 B21R2.4469091 CN(C)CCNC(=O)C1=C(C2=C(C=CC=C2)NC1=O)O MCULE-2241431609 [0,0,0,0,0,0|0,0,4]=4 3 B21R2.4469091 CN(C)CCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-6217853300 [0,0,0,0,0,0|0,0,0]=0 4 B20R2.144379 CC(C)CCNC(=O)C1=CC2=C(CCCC2)N=C1O MCULE-2825088817 [1,0,0,0,0,0|1,0,2]=4 5 B20R2.144379 CN(C)CCNC(=O)C1=CC2=C(CCCC2)N=C1O MCULE-6886127658 [1,0,0,0,0,0|0,0,2]=3 6 B20R2.337244 CCCCNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-4528949725 [1,0,0,0,0,0|1,0,2]=4 7 B20R2.337244 NCCCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-2328450862 [1,0,0,0,0,0|2,0,0]=3 8 B20R2.337244 O=C(NCCCO)C1=C(C2=C(CCCC2)NC1=O)O MCULE-1756979549 [1,0,0,0,0,0|2,0,0]=3 9 B20R2.337244 [NH3+]CCCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-6405402765 [1,0,0,0,0,0|2,0,0]=3 10 B22R2.5903881 C[N+](C)(C)CCNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-4722899672 [0,1,0,0,0,0|0,0,3]=4 11 B22R2.5903881 C[N+](C)(C)CCNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-6806995611 [0,1,0,0,0,0|0,0,3]=4 12 B20R2.536052 CC(C)CNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-2227827594 [0,0,0,0,1,0|1,0,2]=4 13 B22R2.5903880 CN(C)CCCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-8799912004 [0,0,0,0,0,1|0,0,0]=1 14 B19R2.15288 CCCCNC(=O)C1=CC2=C(CCCC2)NC1=O MCULE-3532800972 [2,0,0,0,0,0|1,0,0]=3 15 B19R2.201088 CCCNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-7915204715 [2,0,0,0,0,0|0,0,2]=4 16 B19R2.201088 NCCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-6442641746 [2,0,0,0,0,0|0,0,0]=2 17 B19R2.201088 [NH3+]CCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-7247414493 [2,0,0,0,0,0|0,0,1]=3 18 B21R2.18016665 CC(C)CCNC(=O)C1=CC2=C(CCCC2=O)NC1=O MCULE-3672540224 [1,1,0,0,0,0|1,0,1]=4 19 B21R2.18204182 CC1CCC2=C(C1)C=C(C(=N2)O)C(=O)NCCN(C)C MCULE-9432040299 [1,1,0,0,0,0|0,0,2]=4 20 B21R2.2536070 CCNCCNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-8240264267 [1,1,0,0,0,0|0,0,2]=4 21 B21R2.2536070 COCCCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-2584454269 [1,1,0,0,0,0|1,0,0]=3 22 B23R2.7692310 CC[N+](C)(C)CCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-4734051912 [0,2,0,0,0,0|0,0,1]=3 23 B23R2.7692310 CC[N+](C)(C)CCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-7186686804 [0,2,0,0,0,0|0,0,1]=3 24 B23R2.8666376 CCN(CC)CCNC(=O)C1=C(C2=C(CCCC2)N=C1O)O MCULE-1768029780 [0,2,0,0,0,0|0,0,2]=4 25 B19R2.94063 CN(C)CCNC(=O)C1=CC2=C(CCC2)NC1=O MCULE-2803372843 [1,0,0,0,1,0|0,0,0]=2 26 B21R2.210657 CN(C)CCCNC(=O)C1=CC2=C(CCCC2)N=C1O MCULE-1859618178 [1,0,0,0,0,1|0,0,2]=4 27 B23R2.53703461 CC(C)OCCCNC(=O)C1=C(C2=C(CCCC2)NC1=O)O MCULE-3761622876 [0,0,0,0,0,2|1,0,0]=3