0 B22R2.16343 CCCCOc1ccc(C(=O)CCN2CCCCC2)cc1 Amb6366289 [0,0,0,0,0,0|0,0,0]=0 1 B22R2.16343 CCCCOc1ccc(C(=O)CCN2CCNCC2)cc1 Amb18520867 [0,0,0,0,0,0|1,0,0]=1 2 B22R2.16343 CCCCOc1ccc(C(O)CCN2CCNCC2)cc1 Amb17230500 [0,0,0,0,0,0|1,0,2]=3 3 B21R2.3422 CCCOc1ccc(C(=O)CC[NH+]2CCCCC2)cc1 Amb3996991 [1,0,0,0,0,0|0,0,1]=2 4 B21R2.3422 CCCOc1ccc(C(O)CCN2CCNCC2)cc1 Amb17230437 [1,0,0,0,0,0|1,0,2]=4 5 B21R2.3422 CCCSc1ccc(C(=O)CCN2CCNCC2)cc1 Amb18554172 [1,0,0,0,0,0|1,1,0]=3 6 B21R2.13853 CCCCOc1ccc(CCCN2CCNCC2)cc1 Amb17475998 [1,0,0,0,0,0|1,0,1]=3 7 B23R2.18202 CCCCOc1ccc(C(=O)C(C)CN2CCNCC2)cc1 Amb18552850 [0,1,0,0,0,0|1,0,0]=2 8 B23R2.18202 CCCCOc1ccc(C(O)C(C)CN2CCNCC2)cc1 Amb18553483 [0,1,0,0,0,0|1,0,2]=4 9 B23R2.28732 CCCCCOc1ccc(C(=O)CCN2CCNCC2)cc1 Amb18275202 [0,1,0,0,0,0|1,0,0]=2 10 B23R2.28732 CCCCCOc1ccc(C(O)CCN2CCNCC2)cc1 Amb18940471 [0,1,0,0,0,0|1,0,2]=4 11 B23R3.15975489 CN1CCCc2ccc(C(=O)CCN3CCNCC3)cc21 Amb18054647 [0,0,0,1,0,0|3,0,0]=4 12 B21R2.13804 CCCCOc1ccc(C(=O)CN2CCNCC2)cc1 Amb18553486 [0,0,0,0,1,0|1,0,0]=2 13 B21R2.13804 CCCCOc1ccc(C(O)CN2CCNCC2)cc1 Amb18553487 [0,0,0,0,1,0|1,0,2]=4 14 B23R2.2801 COCCOc1ccc(C(=O)NCCC2=CCCCC2)cc1 Amb6542477 [0,0,0,0,0,1|2,0,1]=4 15 B20R2.3356 CCCOc1ccc(CCCN2CCNCC2)cc1 Amb17476124 [2,0,0,0,0,0|1,0,1]=4 16 B20R2.3356 CCNCc1ccc(OCCN2CCCCC2)cc1 Amb17146287 [2,0,0,0,0,0|2,0,0]=4 17 B20R2.4553 CCOc1ccc(C(=O)CCN2CCNCC2)cc1 Amb17219592 [2,0,0,0,0,0|1,0,0]=3 18 B20R2.4553 CCOc1ccc(C(O)CCN2CCCCC2)cc1 Amb17230389 [2,0,0,0,0,0|0,0,2]=4 19 B20R2.4553 CCSc1ccc(C(=O)CCC2CCCCC2)cc1 Amb17482524 [2,0,0,0,0,0|1,1,0]=4 20 B20R2.4553 CCSc1ccc(C(=O)CCN2CCNCC2)cc1 Amb18055300 [2,0,0,0,0,0|1,1,0]=4 21 B22R2.3385 CCCOc1ccc(C(=O)C(C)CN2CCNCC2)cc1 Amb18054548 [1,1,0,0,0,0|1,0,0]=3 22 B22R2.3385 CCCSc1ccc(C(=O)C(C)CN2CCNCC2)cc1 Amb18055294 [1,1,0,0,0,0|1,1,0]=4 23 B22R2.15257 CC(C)COc1ccc(C(=O)CCN2CCNCC2)cc1 Amb18054545 [1,1,0,0,0,0|1,0,0]=3 24 B22R2.26533 CCCOc1ccc(C(=O)CCN2CCNCC2)c(C)c1 Amb18554070 [1,1,0,0,0,0|1,0,0]=3 25 B22R2.26533 CCCOc1ccc(C(=O)CCN2CCNCC2)c(Cl)c1 Amb18057504 [1,1,0,0,0,0|1,0,0]=3 26 B22R2.26091 CCCCCOc1ccc(CCCN2CCNCC2)cc1 Amb17475912 [1,1,0,0,0,0|1,0,1]=4 27 B22R2.16340 CCCCOc1ccc(C(=O)C(C)N2CCNCC2)cc1 Amb18553470 [0,1,0,0,1,0|1,0,0]=3 28 B22R2.26043 CCCCCOc1ccc(C(=O)CN2CCNCC2)cc1 Amb18275203 [0,1,0,0,1,0|1,0,0]=3 29 B22R2.26043 CCOCCOc1ccc(C(=O)NC2CCCCC2)cc1 Amb2070940 [0,1,0,0,1,0|2,0,0]=4 30 B22R2.376226 CCCCOc1ccc(C(=O)NC2CCCCC2N)cc1 Amb24189725 [0,1,0,0,1,0|2,0,0]=4 31 B22R2.376226 CCCCOc1ccc(C(=O)NC2CCCCC2N)cc1 Amb33276222 [0,1,0,0,1,0|2,0,0]=4 32 B24R2.32012 CCCCCCOc1ccc(C(=O)CCN2CCNCC2)cc1 Amb18553496 [0,2,0,0,0,0|1,0,0]=3 33 B22R3.63903 O=C(CCN1CCNCC1)c2ccc3c(c2)CCCC3 Amb17219576 [1,0,0,1,0,0|1,0,0]=3 34 B22R3.63903 O=C(CCN1CCNCC1)c2ccc3c(c2)CCCO3 Amb18234586 [1,0,0,1,0,0|1,0,0]=3 35 B22R3.63903 O=C(CCN1CCNCC1)c2ccc3c(c2)NCCC3 Amb18553657 [1,0,0,1,0,0|2,0,0]=4 36 B22R3.63903 O=C(CCN1CCNCC1)c2ccc3c(c2)OCCO3 Amb17219586 [1,0,0,1,0,0|2,0,0]=4 37 B22R3.63903 O=C(CCN1CCOCC1)c2ccc3c(c2)OCCO3 Amb2736954 [1,0,0,1,0,0|2,0,0]=4 38 B22R3.2803103 O=C(CCN1CCCC1)c2ccc3c(c2)OCCCO3 Amb17366784 [0,0,0,1,1,0|1,0,0]=3 39 B22R3.36339 O=C(CN1CCCCC1)c2ccc3c(c2)OCCCO3 Amb17278391 [0,0,0,1,1,0|1,0,0]=3 40 B22R3.36339 O=C(CN1CCNCC1)c2ccc3c(c2)OCCCO3 Amb17197699 [0,0,0,1,1,0|2,0,0]=4 41 B22R3.36339 O=C(CN1CCOCC1)c2ccc3c(c2)OCCCO3 Amb17280066 [0,0,0,1,1,0|2,0,0]=4 42 B24R3.41941815 CCN1CCCc2ccc(C(=O)CCN3CCNCC3)cc21 Amb18054680 [0,1,0,1,0,0|2,0,0]=4 43 B20R2.3309 CCCOc1ccc(C(=O)CN2CCNCC2)cc1 Amb18553476 [1,0,0,0,1,0|1,0,0]=3 44 B20R2.3309 CCCOc1ccc(C(Cl)CN2CCCCC2)cc1 Amb17547688 [1,0,0,0,1,0|1,0,1]=4 45 B20R2.3309 CCCOc1ccc(C(O)CN2CCCCC2)cc1 Amb17549673 [1,0,0,0,1,0|0,0,2]=4 46 B20R2.3309 CCCSc1ccc(C(=O)CN2CCNCC2)cc1 Amb18554171 [1,0,0,0,1,0|1,1,0]=4 47 B20R2.11318 CCCCOc1ccc(CCN2CCNCC2)cc1 Amb18553489 [1,0,0,0,1,0|1,0,0]=3 48 B20R2.11291 CCCCOc1ccc(C(=O)N2CCNCC2)cc1 Amb6281193 [0,0,0,0,2,0|1,0,0]=3 49 B20R2.11291 O=C(c1ccc(OCCCBr)cc1)N2CCCCC2 Amb17329683 [0,0,0,0,2,0|1,0,0]=3 50 B22R2.16374 CCCCOc1ccc(OCCCN2CCOCC2)cc1 Amb8387081 [1,0,0,0,0,1|1,0,1]=4