0 B15R1.1289 O=NN(CCCl)C(=O)NC1CCCCC1 MCULE-6734536219 [0,0,0,0,0,0|0,0,0]=0 1 B14R1.60 CCOC(=O)C(=O)NC1CCCCC1 MCULE-9266160151 [1,0,0,0,0,0|3,0,0]=4 2 B14R1.60 CN(CCO)C(=O)NC1CCCCC1 MCULE-4859279602 [1,0,0,0,0,0|2,0,0]=3 3 B14R1.532 CCN(CC)C(=O)NC1CCCCC1 MCULE-5580253276 [1,0,0,0,0,0|2,0,0]=3 4 B14R1.532 CCN(CC)C(=O)NC1CCNCC1 MCULE-5350070378 [1,0,0,0,0,0|3,0,0]=4 5 B14R1.532 CCN(CC)C(=O)NC1CCNCC1 MCULE-8749052289 [1,0,0,0,0,0|3,0,0]=4 6 B14R1.532 CCN(CC)C(=S)NC1CCCCC1 MCULE-8925872078 [1,0,0,0,0,0|2,1,0]=4 7 B16R1.1576 CC1CCC(CC1)NC(=O)N(CCCl)N=O MCULE-3473179478 [0,1,0,0,0,0|0,0,0]=1 8 B16R2.88 O=C(NC1CCCCC1)N2CC=CCC2 MCULE-9789943487 [0,0,0,1,0,0|3,0,0]=4 9 B16R2.88 O=C(NC1CCCCC1)N2CCCCC2 MCULE-1230746695 [0,0,0,1,0,0|3,0,0]=4 10 B16R2.88 O=C(NC1CCCCC1)N2CCNCC2 MCULE-6525987303 [0,0,0,1,0,0|3,0,0]=4 11 B16R2.88 O=C(NC1CCCCC1)N2CCNCC2 MCULE-9057727263 [0,0,0,1,0,0|3,0,0]=4 12 B16R2.88 O=C(NC1CCCCC1)N2CCOCC2 MCULE-7286140220 [0,0,0,1,0,0|3,0,0]=4 13 B16R2.88 O=C(NC1CCCCC1)N2CCSCC2 MCULE-5424352736 [0,0,0,1,0,0|3,0,0]=4 14 B16R2.2843 N[C@H]1CCN(C1)C(=O)NC2CCCCC2 MCULE-7686688761 [0,0,0,1,0,0|3,0,0]=4 15 B16R2.2843 O=C(NC1CCCCC1)N2CC(CO2)O MCULE-1643723371 [0,0,0,1,0,0|3,0,0]=4 16 B16R2.3005 O=C1NCCN1C(=O)NC2CCCCC2 MCULE-6955070303 [0,0,0,1,0,0|2,0,0]=3 17 B16R2.114860 C=CCN1C(=O)NC2(C1=O)CCCCC2 MCULE-3205088411 [0,0,0,1,0,0|2,0,1]=4 18 B16R2.114860 O=C1NC2(CCCCC2)C(=O)N1CCO MCULE-1178670478 [0,0,0,1,0,0|2,0,0]=3 19 B13R0.1065 O=NN(CCCl)C(=O)NC(CO)CO MCULE-3721453313 [1,0,1,0,0,0|2,0,0]=4 20 B13R1.44 C=CCNC(=O)NC1CCCCC1 MCULE-3455167772 [2,0,0,0,0,0|1,0,1]=4 21 B13R1.44 CCCCC(=O)NC1CCCCC1 MCULE-6806749220 [2,0,0,0,0,0|2,0,0]=4 22 B13R1.44 CCCNC(=S)NC1CCCCC1 MCULE-7957394034 [2,0,0,0,0,0|1,1,0]=4 23 B13R1.44 CCCOC(=O)NC1CCCCC1 MCULE-8501561862 [2,0,0,0,0,0|2,0,0]=4 24 B13R1.44 NCCNC(=O)CC1CCCCC1 MCULE-3265455768 [2,0,0,0,0,0|2,0,0]=4 25 B13R1.44 NCCNC(=O)CC1CCCCC1 MCULE-6082300618 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.44 NCCNC(=O)NC1CCCCC1 MCULE-1829521438 [2,0,0,0,0,0|1,0,0]=3 27 B13R1.44 NCCNC(=O)NC1CCCCC1 MCULE-6200408938 [2,0,0,0,0,0|1,0,0]=3 28 B13R1.44 O=C(CCCCl)NC1CCCCC1 MCULE-8519084978 [2,0,0,0,0,0|1,0,0]=3 29 B13R1.44 O=C(NCCBr)NC1CCCCC1 MCULE-4421854707 [2,0,0,0,0,0|0,1,0]=3 30 B13R1.44 O=C(NCCCl)NC1CCCCC1 MCULE-7520015322 [2,0,0,0,0,0|0,0,0]=2 31 B13R1.44 O=C(NCCO)NC1CCCCC1 MCULE-9777164995 [2,0,0,0,0,0|1,0,0]=3 32 B13R1.44 OCCNC(=S)NC1CCCCC1 MCULE-7773715806 [2,0,0,0,0,0|1,1,0]=4 33 B13R1.135 CCC(Br)C(=O)NC1CCCCC1 MCULE-6381638464 [2,0,0,0,0,0|2,0,0]=4 34 B15R1.551 O=C(NCCO)C(=O)NC1CCCCC1 MCULE-5788665323 [1,1,0,0,0,0|2,0,0]=4 35 B15R2.64 O=C(NC1CCCCC1)N2CCCC2 MCULE-9027582451 [1,0,0,1,0,0|2,0,0]=4 36 B15R2.64 O=C(NC1CCCCC1)N2CCSC2 MCULE-1330840371 [1,0,0,1,0,0|2,0,0]=4 37 B15R2.596 O=C(NC1CCCCC1)N2CC(C2)O MCULE-6417053658 [1,0,0,1,0,0|2,0,0]=4 38 B15R2.56563 NCCN1C(=O)NC2(C1=O)CCCC2 MCULE-4310429155 [0,0,0,1,1,0|2,0,0]=4 39 B15R2.56563 NCCN1C(=O)NC2(C1=O)CCCC2 MCULE-6333112131 [0,0,0,1,1,0|2,0,0]=4 40 B15R2.56563 O=C1NC2(CCCC2)C(=O)N1CCBr MCULE-5647445646 [0,0,0,1,1,0|1,1,0]=4 41 B17R2.5273 O=C1CN(CCN1)C(=O)NC2CCCCC2 MCULE-3087516481 [0,1,0,1,0,0|2,0,0]=4 42 B17R2.340779 N#CCCN1C(=O)NC2(C1=O)CCCCC2 MCULE-5654087278 [0,1,0,1,0,0|2,0,0]=4 43 B17R2.340779 NCCCN1C(=O)NC2(C1=O)CCCCC2 MCULE-1389955473 [0,1,0,1,0,0|2,0,0]=4 44 B17R2.340779 O=C1NC2(CCCCC2)C(=O)N1CCCO MCULE-9067788651 [0,1,0,1,0,0|2,0,0]=4 45 B15R1.477 CCN(CC)CC(=O)NC1CCCCC1 MCULE-6080437853 [1,0,0,0,0,1|2,0,0]=4 46 B15R1.477 CCN(CC)CC(=O)NC1CCCCC1 MCULE-7164614323 [1,0,0,0,0,1|2,0,0]=4 47 B15R1.18643 CCN(CC)C(=O)NC1CCCCCC1 MCULE-2122467190 [1,0,0,0,0,1|2,0,0]=4