0 B23R2.186150 O=C(NC(C(=O)O)Cc1ccccc1)OCc2ccccc2 1P003TCD [0,0,0,0,0,0|1,0,0]=1 1 B23R2.186150 O=C(N[C@@H](C(=O)N)Cc1ccccc1)OCc2ccccc2 1P006UTZ [0,0,0,0,0,0|0,0,0]=0 2 B23R2.186150 O=C(N[C@@H](C(=O)O)Cc1ccccc1)OCc2ccccc2 1P0038LQ [0,0,0,0,0,0|1,0,0]=1 3 B23R2.186150 O=C(N[C@H](C(=O)N)Cc1ccccc1)OCc2ccccc2 1P00D9NH [0,0,0,0,0,0|0,0,0]=0 4 B23R2.186150 O=C(N[C@H](C(=O)O)Cc1ccccc1)OCc2ccccc2 1P0035U4 [0,0,0,0,0,0|1,0,0]=1 5 B23R2.186150 O=C(N[C@H](C(=O)O)Cc1ccccc1)\C=C\c2ccccc2 1P00DHCL [0,0,0,0,0,0|2,0,1]=3 6 B22R2.17679 NC[C@@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P00D7WF [1,0,0,0,0,0|0,0,1]=2 7 B22R2.17679 NC[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P00BA9V [1,0,0,0,0,0|0,0,1]=2 8 B22R2.17679 O=C[C@@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P00EDB7 [1,0,0,0,0,0|0,0,0]=1 9 B22R2.17679 O=C[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P00EDBA [1,0,0,0,0,0|0,0,0]=1 10 B22R2.17679 OC[C@@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P003P6O [1,0,0,0,0,0|0,0,2]=3 11 B22R2.17679 OC[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P003D16 [1,0,0,0,0,0|0,0,2]=3 12 B24R2.136536 COC(=O)[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P007DQK [0,1,0,0,0,0|1,0,0]=2 13 B24R2.136536 ClCC(=O)[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P002RZ1 [0,1,0,0,0,0|1,0,0]=2 14 B24R2.213397 N[C@@H](C(=O)N[C@@H](C(=O)O)Cc1ccccc1)Cc2ccccc2 1P00EDXT [0,1,0,0,0,0|2,0,0]=3 15 B24R2.213397 N[C@H](C(=O)N[C@@H](C(=O)O)Cc1ccccc1)Cc2ccccc2 1P0280RD [0,1,0,0,0,0|2,0,0]=3 16 B24R2.213397 N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc2ccccc2 1P00I5DS [0,1,0,0,0,0|2,0,0]=3 17 B24R2.213399 OC(=O)C(N(C(=O)OCc1ccccc1)C)Cc2ccccc2 1P01JLYK [0,1,0,0,0,0|1,0,0]=2 18 B24R2.213399 OC(=O)[C@@H](N(C(=O)OCc1ccccc1)C)Cc2ccccc2 1P002VL0 [0,1,0,0,0,0|1,0,0]=2 19 B24R2.213399 OC(=O)[C@H](N(C(=O)OCc1ccccc1)C)Cc2ccccc2 1P008RO9 [0,1,0,0,0,0|1,0,0]=2 20 B24R2.6392864 Oc1cccc(c1)CC(C(=O)O)NC(=O)OCc2ccccc2 1P028H98 [0,1,0,0,0,0|1,0,0]=2 21 B24R2.10801185 O=C(N[C@H](C(=O)O)Cc1ccccc1F)OCc2ccccc2 1P000XYI [0,1,0,0,0,0|1,0,0]=2 22 B24R2.16710537 O=C(NC(C(=O)O)Cc1ccc(cc1)Cl)OCc2ccccc2 1P00DAHQ [0,1,0,0,0,0|1,0,0]=2 23 B24R2.16710537 O=C(NC(C(=O)O)Cc1ccc(cc1)O)OCc2ccccc2 1P00E1NS [0,1,0,0,0,0|1,0,0]=2 24 B24R2.16710537 O=C(N[C@@H](C(=O)O)Cc1ccc(cc1)F)OCc2ccccc2 1P000ETG [0,1,0,0,0,0|1,0,0]=2 25 B24R2.16710537 O=C(N[C@@H](C(=O)O)Cc1ccc(cc1)O)OCc2ccccc2 1P003VU9 [0,1,0,0,0,0|1,0,0]=2 26 B24R2.16710537 O=C(N[C@H](C(=O)N)Cc1ccc(cc1)O)OCc2ccccc2 1P002CBR [0,1,0,0,0,0|0,0,0]=1 27 B24R2.16710537 O=C(N[C@H](C(=O)O)Cc1ccc(cc1)C)OCc2ccccc2 1P01JMT1 [0,1,0,0,0,0|1,0,0]=2 28 B24R2.16710537 O=C(N[C@H](C(=O)O)Cc1ccc(cc1)F)OCc2ccccc2 1P0021G0 [0,1,0,0,0,0|1,0,0]=2 29 B24R2.16710537 O=C(N[C@H](C(=O)O)Cc1ccc(cc1)I)OCc2ccccc2 1P00C23G [0,1,0,0,0,0|1,0,0]=2 30 B24R2.16710537 O=C(N[C@H](C(=O)O)Cc1ccc(cc1)O)OCc2ccccc2 1P000CVF [0,1,0,0,0,0|1,0,0]=2 31 B24R3.57365 O=C1N[C@@H](Cc2ccccc2)C(=O)N[C@H]1Cc3ccccc3 1P002WCP [0,0,0,1,0,0|1,0,0]=2 32 B24R3.433295 OC(=O)[C@H]1Cc2c(N1C(=O)OCc3ccccc3)cccc2 1P028UYQ [0,0,0,1,0,0|1,0,0]=2 33 B22R2.149711 O=C(N[C@H](C(=O)O)Cc1ccccc1)Cc2ccccc2 1P008Q5P [0,0,0,0,1,0|1,0,0]=2 34 B22R2.149722 O=C(C[C@@H](c1ccccc1)C(=O)O)OCc2ccccc2 1P009BPD [0,0,0,0,1,0|2,0,0]=3 35 B22R2.149722 O=C(NC(c1ccccc1)C(=O)O)OCc2ccccc2 1P00F4PI [0,0,0,0,1,0|1,0,0]=2 36 B22R2.149722 O=C(N[C@@H](c1ccccc1)C(=O)O)OCc2ccccc2 1P003VVT [0,0,0,0,1,0|1,0,0]=2 37 B22R2.149722 O=C(N[C@H](c1ccccc1)C(=O)O)OCc2ccccc2 1P0021W9 [0,0,0,0,1,0|1,0,0]=2 38 B22R2.4115567 O=C(N[C@@H](C(=O)O)Cc1c[nH]cn1)OCc2ccccc2 1P006HYG [0,0,0,0,1,0|3,0,0]=4 39 B22R2.4115567 O=C(N[C@H](C(=O)O)Cc1c[nH]cn1)OCc2ccccc2 1P002B68 [0,0,0,0,1,0|3,0,0]=4 40 B24R2.46020 OC(=O)C[C@H](Cc1ccccc1)NC(=O)OCc2ccccc2 1P01FSWV [0,0,0,0,0,1|1,0,0]=2 41 B24R2.46110 O=C(N[C@@H](C(=O)O)CCc1ccccc1)OCc2ccccc2 1P001A40 [0,0,0,0,0,1|1,0,0]=2 42 B24R2.46110 O=C(N[C@H](C(=O)O)CCc1ccccc1)OCc2ccccc2 1P000XYH [0,0,0,0,0,1|1,0,0]=2 43 B24R2.46110 O=C(N[C@H](C(=O)O)CSc1ccccc1)OCc2ccccc2 1P001R61 [0,0,0,0,0,1|1,0,0]=2 44 B23R2.734224 O=C(N[C@@H](c1ccc(cc1)O)C(=O)O)OCc2ccccc2 1P00BGRA [0,1,0,0,1,0|1,0,0]=3 45 B23R2.734224 O=C(N[C@H](c1ccc(cc1)O)C(=O)O)OCc2ccccc2 1P00C4UT [0,1,0,0,1,0|1,0,0]=3 46 B25R2.739322 O=C(N[C@@H]([C@@H](C(=O)O)O)Cc1ccccc1)OCc2ccccc2 1P00IB3N [0,1,0,0,0,1|1,0,0]=3 47 B25R2.147511 COC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)N)Cc2ccccc2 1P00C8FP [0,2,0,0,0,0|2,0,0]=4 48 B25R2.6091126 COC(=O)[C@@H](Cc1ccc(cc1)O)NC(=O)OCc2ccccc2 1P000MHZ [0,2,0,0,0,0|1,0,0]=3 49 B25R2.6091126 COC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)OCc2ccccc2 1P009DOT [0,2,0,0,0,0|1,0,0]=3 50 B25R2.7752940 OC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc2ccccc2)N 1P001ZHQ [0,2,0,0,0,0|2,0,0]=4 51 B25R2.7753043 O=C([C@H](Cc1ccc(cc1)O)N)N[C@H](C(=O)O)Cc2ccccc2 1P001ZHR [0,2,0,0,0,0|2,0,0]=4 52 B25R2.23187049 O=C(N[C@H](C(=O)O)Cc1ccc(c(c1)O)O)OCc2ccccc2 1P01FZRH [0,2,0,0,0,0|1,0,0]=3 53 B25R2.130467912 O=C(N[C@@H](C(=O)O)Cc1ccc(cc1F)F)OCc2ccccc2 1P01DUMP [0,2,0,0,0,0|1,0,0]=3 54 B25R2.373967 N#Cc1ccc(cc1)C[C@@H](C(=O)O)NC(=O)OCc2ccccc2 1P00100X [0,2,0,0,0,0|1,0,0]=3 55 B25R3.3959216 OC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OCc3ccccc3 1P003D4P [0,1,0,1,0,0|1,0,0]=3 56 B25R3.3959216 [O-]C(=O)[C@H]1Cc2ccccc2CN1C(=O)OCc3ccccc3 1P001EOY [0,1,0,1,0,0|1,0,0]=3 57 B21R2.15276 CN[C@H](C(=O)OCc1ccccc1)Cc2ccccc2 1P00C6O0 [1,0,0,0,1,0|2,0,0]=4 58 B21R2.15366 NC[C@@H](c1ccccc1)NC(=O)OCc2ccccc2 1P00A89A [1,0,0,0,1,0|0,0,1]=3 59 B21R2.15366 NC[C@H](c1ccccc1)NC(=O)OCc2ccccc2 1P00A89B [1,0,0,0,1,0|0,0,1]=3 60 B21R2.257448 [O-]C(=O)C(c1ccccc1)C(=O)NCc2ccccc2 1P028QC3 [0,0,0,0,2,0|2,0,0]=4 61 B21R2.111274 NC(=O)[C@@H](NC(=O)c1ccccc1)Cc2ccccc2 1P005K9P [0,0,0,0,2,0|0,0,0]=2 62 B21R2.111274 NC(=O)[C@@H](NC(=O)c1nccnc1)Cc2ccccc2 1P002XMG [0,0,0,0,2,0|2,0,0]=4 63 B21R2.111274 OC(=O)C(NC(=O)c1cccnc1)Cc2ccccc2 1P00VSWG [0,0,0,0,2,0|2,0,0]=4 64 B21R2.111274 OC(=O)[C@@H](NC(=O)c1ccccc1)Cc2ccccc2 1P002VNX [0,0,0,0,2,0|1,0,0]=3 65 B21R2.111274 [O-]C(=O)C(NC(=O)c1ccccc1)Cc2cccnc2 1P01FLD6 [0,0,0,0,2,0|2,0,0]=4 66 B23R2.43168 O=C(NC(c1ccccc1)CC(=O)O)OCc2ccccc2 1P019YS3 [0,0,0,0,1,1|1,0,0]=3 67 B25R2.16097622 O=C(N[C@H](C(=O)O)CNCc1ccccc1)OCc2ccccc2 1P001VW3 [0,0,0,0,0,2|1,0,0]=3 68 B25R2.16097622 O=C(N[C@H](C(=O)O)COCc1ccccc1)OCc2ccccc2 1P002JXY [0,0,0,0,0,2|1,0,0]=3 69 B25R2.16097622 O=C(N[C@H](C(=O)O)CSCc1ccccc1)OCc2ccccc2 1P003TCH [0,0,0,0,0,2|1,0,0]=3