0 B39R5.197822527 CCC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)C4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0741_SB0053 [0,0,0,0,0,0|2,0,2]=4 1 B39R5.197822527 CCC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0369_SB0053 [0,0,0,0,0,0|1,0,2]=3 2 B39R5.197822527 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(CO)c5ccccc5 LN00170117_SD0369_SB3228 [0,0,0,0,0,0|2,0,2]=4 3 B39R5.197822527 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)C4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0741_SB0081 [0,0,0,0,0,0|1,0,2]=3 4 B39R5.197822527 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0369_SB0081 [0,0,0,0,0,0|0,0,2]=2 5 B38R5.7664405 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCCCC4)c2C1)c5ccccc5 LN00170117_SD0577_SB0081 [1,0,0,0,0,0|1,0,2]=4 6 B38R5.7664405 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCOCC4)c2C1)c5ccccc5 LN00170117_SC0190_SB0081 [1,0,0,0,0,0|1,0,2]=4 7 B38R5.59021218 CC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)C4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0741_SB2326 [1,0,0,0,0,0|1,0,2]=4 8 B38R5.59021218 CC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0369_SB2326 [1,0,0,0,0,0|0,0,2]=3 9 B38R5.59021218 CN1CCC(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(O)c5ccccc5 LN00170117_SD0741_SB0168 [1,0,0,0,0,0|1,0,2]=4 10 B38R5.59021218 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(O)c5ccccc5 LN00170117_SD0369_SB0168 [1,0,0,0,0,0|0,0,2]=3 11 B40R5.94024581 CCC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)CC)c2C1)c5ccccc5 LN00170117_SD0288_SB0053 [0,1,0,0,0,0|1,0,2]=4 12 B40R5.94024581 CCN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)[C@H](OC)c5ccccc5 LN00170117_SD0288_SB0081 [0,1,0,0,0,0|0,0,2]=3 13 B40R5.206225665 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCC(CC4)(C)C)c2C1)c5ccccc5 LN00170117_SD0749_SB0081 [0,1,0,0,0,0|1,0,2]=4 14 B40R5.517477729 CC(C)C(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0369_SB4495 [0,1,0,0,0,0|1,0,2]=4 15 B40R5.976486056 CCC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3Cl)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0353_SB0053 [0,1,0,0,0,0|1,0,2]=4 16 B40R5.976486056 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3Cl)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0353_SB0081 [0,1,0,0,0,0|0,0,2]=3 17 B40R6.58389978 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C5(CC5)c6ccccc6 LN00170117_SD0369_SB0039 [0,0,0,1,0,0|1,0,2]=4 18 B40R6.158961544 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C5CCc6c5cccc6 LN00170117_SD0369_SB3073 [0,0,0,1,0,0|1,0,2]=4 19 B40R5.206223082 CCC(C(=O)N1Cc2ccc(cc2C1)NC(=O)c3ccc(cc3)N4CCN(CC4)C)c5ccccc5 LN00007073_SD0369_SB0053 [0,0,0,0,0,1|3,0,0]=4 20 B40R5.206223082 CO[C@@H](C(=O)N1Cc2ccc(cc2C1)NC(=O)c3ccc(cc3)C4CCN(CC4)C)c5ccccc5 LN00007073_SD0741_SB0081 [0,0,0,0,0,1|3,0,0]=4 21 B40R5.206223082 CO[C@@H](C(=O)N1Cc2ccc(cc2C1)NC(=O)c3ccc(cc3)N4CCN(CC4)C)c5ccccc5 LN00007073_SD0369_SB0081 [0,0,0,0,0,1|2,0,0]=3 22 B40R5.616833598 CCC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)CN4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0750_SB0053 [0,0,0,0,0,1|1,0,2]=4 23 B40R5.616833598 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)CN4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0750_SB0081 [0,0,0,0,0,1|0,0,2]=3 24 B37R5.24561584 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)Cc5ccccc5 LN00170117_SD0369_SB0092 [2,0,0,0,0,0|0,0,2]=4 25 B39R5.15835102 CCN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(C)c5ccccc5 LN00170117_SD0288_SB2326 [1,1,0,0,0,0|0,0,2]=4 26 B39R5.15835102 CCN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(O)c5ccccc5 LN00170117_SD0288_SB0168 [1,1,0,0,0,0|0,0,2]=4 27 B39R5.74519111 CC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3Cl)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0353_SB2326 [1,1,0,0,0,0|0,0,2]=4 28 B39R5.74519111 CN1CCN(CC1)c2ccc(c(c2)Cl)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(O)c5ccccc5 LN00170117_SD0353_SB0168 [1,1,0,0,0,0|0,0,2]=4 29 B39R5.165735140 CC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccc(cc5)Cl LN00170117_SD0369_SB0484 [1,1,0,0,0,0|0,0,2]=4 30 B39R5.165735140 CC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccc(cc5)O LN00170117_SD0369_SB5200 [1,1,0,0,0,0|0,0,2]=4 31 B39R5.165735140 Cc1ccc(cc1)C(C)C(=O)N2Cc3[nH][nH]c(=NC(=O)c4ccc(cc4)N5CCN(CC5)C)c3C2 LN00170117_SD0369_SB0423 [1,1,0,0,0,0|0,0,2]=4 32 B39R5.165735141 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)[C@H](O)c5ccccc5Cl LN00170117_SD0369_SB3309 [1,1,0,0,0,0|0,0,2]=4 33 B39R5.165735195 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(C)(C)c5ccccc5 LN00170117_SD0369_SB0135 [1,1,0,0,0,0|0,0,2]=4 34 B39R5.773849340 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(O)c5cccc(c5)Br LN00170117_SD0369_SA00095 [1,1,0,0,0,0|0,0,2]=4 35 B41R5.14945421 CCN1CCN(CC1)c2ccc(cc2)C(=O)Nc3ccc4c(c3)CN(C4)C(=O)[C@H](OC)c5ccccc5 LN00007073_SD0288_SB0081 [0,1,0,0,0,1|2,0,0]=4 36 B41R5.957388552 CO[C@@H](C(=O)N1Cc2ccc(cc2C1)NC(=O)c3ccc(cc3Cl)N4CCN(CC4)C)c5ccccc5 LN00007073_SD0353_SB0081 [0,1,0,0,0,1|2,0,0]=4 37 B41R5.618950971 CCCN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)[C@H](OC)c5ccccc5 LN00170117_SD2629_SB0081 [0,2,0,0,0,0|0,0,2]=4 38 B37R5.138540382 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCCC4)c2C1)c5ccccc5 LN00170117_SD0592_SB0081 [1,0,0,0,1,0|0,0,2]=4 39 B39R5.304648 CC(C(=O)N1Cc2ccc(cc2C1)NC(=O)c3ccc(cc3)N4CCN(CC4)C)c5ccccc5 LN00007073_SD0369_SB2326 [1,0,0,0,0,1|2,0,0]=4 40 B39R5.304648 CN1CCN(CC1)c2ccc(cc2)C(=O)Nc3ccc4c(c3)CN(C4)C(=O)C(O)c5ccccc5 LN00007073_SD0369_SB0168 [1,0,0,0,0,1|2,0,0]=4 41 B39R5.163327550 CC(C(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)CN4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0750_SB2326 [1,0,0,0,0,1|0,0,2]=4 42 B39R5.163327550 CN1CCN(CC1)Cc2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)C(O)c5ccccc5 LN00170117_SD0750_SB0168 [1,0,0,0,0,1|0,0,2]=4 43 B39R5.165735127 CC(Cc1ccccc1)C(=O)N2Cc3[nH][nH]c(=NC(=O)c4ccc(cc4)N5CCN(CC5)C)c3C2 LN00170117_SD0369_SB3205 [1,0,0,0,0,1|0,0,2]=4 44 B39R5.165735127 CC(Oc1ccccc1)C(=O)N2Cc3[nH][nH]c(=NC(=O)c4ccc(cc4)N5CCN(CC5)C)c3C2 LN00170117_SD0369_SB0426 [1,0,0,0,0,1|0,0,2]=4 45 B39R5.165735127 CC(Sc1ccccc1)C(=O)N2Cc3[nH][nH]c(=NC(=O)c4ccc(cc4)N5CCN(CC5)C)c3C2 LN00170117_SD0369_SB9992 [1,0,0,0,0,1|0,0,2]=4 46 B39R5.165735127 C[C@@H](Oc1ccccc1)C(=O)N2Cc3[nH][nH]c(=NC(=O)c4ccc(cc4)N5CCN(CC5)C)c3C2 LN00170117_SD0369_SB5803 [1,0,0,0,0,1|0,0,2]=4 47 B39R5.165735154 CC(CC(=O)N1Cc2[nH][nH]c(=NC(=O)c3ccc(cc3)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0369_SB0419 [1,0,0,0,0,1|0,0,2]=4 48 B39R5.165735154 CN1CCN(CC1)c2ccc(cc2)C(=O)N=c3[nH][nH]c4c3CN(C4)C(=O)CC(O)c5ccccc5 LN00170117_SD0369_SB2325 [1,0,0,0,0,1|0,0,2]=4 49 B39R5.607229875 CO[C@@H](C(=O)N1Cc2[nH][nH]c(=NC(=O)c3cccc(c3)N4CCN(CC4)C)c2C1)c5ccccc5 LN00170117_SD0769_SB0081 [0,0,0,0,1,1|0,0,2]=4 50 B41R5.199749194 CO[C@@H](C(=O)N1CCc2ccc(cc2C1)NC(=O)c3ccc(cc3)N4CCN(CC4)C)c5ccccc5 LN00175301_SD0369_SB0081 [0,0,0,0,0,2|2,0,0]=4 51 B41R5.199749194 CO[C@@H](C(=O)N1CCc2ncc(cc2C1)NC(=O)c3ccc(cc3)N4CCN(CC4)C)c5ccccc5 LN00007582_SD0369_SB0081 [0,0,0,0,0,2|1,0,1]=4 52 B41R5.610392811 CO[C@@H](C(=O)N1Cc2ccc(cc2C1)NC(=O)c3ccc(cc3)CN4CCN(CC4)C)c5ccccc5 LN00007073_SD0750_SB0081 [0,0,0,0,0,2|2,0,0]=4 53 B41R5.610448156 CO[C@@H](C(=O)N1CCc2cc(ccc2C1)NC(=O)c3ccc(cc3)N4CCN(CC4)C)c5ccccc5 LN00174971_SD0369_SB0081 [0,0,0,0,0,2|2,0,0]=4