0 B29R3.143110679 C#CC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB0338 [0,0,0,0,0,1|2,0,1]=4 1 B29R3.143110679 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB0064 [0,0,0,0,0,1|2,0,0]=3 2 B29R3.143110679 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2csc3c2cccc3 LN00144600_AG0052_SB0064 [0,0,0,0,0,1|3,0,0]=4 3 B29R3.143110679 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)I)Cc2c[nH]c3c2cccc3 LN00146311_AG0649_SB0064 [0,0,0,0,0,1|3,0,0]=4 4 B29R3.143110679 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)O)Cc2c[nH]c3c2cccc3 LN00146311_AG00200_SB0064 [0,0,0,0,0,1|3,0,0]=4 5 B29R3.143110679 CCC(=O)N[C@H](CC(=O)Nc1cccc(n1)C)Cc2c[nH]c3c2cccc3 LN00146311_AF0019_SB0064 [0,0,0,0,0,1|3,0,0]=4 6 B29R3.143110679 CCC(=O)N[C@H](CC(=O)Nc1cncc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AF0136_SB0064 [0,0,0,0,0,1|3,0,0]=4 7 B29R3.143110679 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)Br LN00146311_AK00442_SB0099 [0,0,0,0,0,1|3,0,0]=4 8 B29R3.143110679 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)C LN00146311_AK00442_SB0105 [0,0,0,0,0,1|2,0,0]=3 9 B29R3.143110679 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)Cl LN00146311_AK00442_SB0101 [0,0,0,0,0,1|3,0,0]=4 10 B29R3.143110679 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)F LN00146311_AK00442_SB0100 [0,0,0,0,0,1|3,0,0]=4 11 B29R3.143110679 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)O LN00146311_AK00442_SB0104 [0,0,0,0,0,1|3,0,0]=4 12 B29R3.143110679 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(n3)C LN00146311_AK00442_SA0399 [0,0,0,0,0,1|3,0,0]=4 13 B29R3.143110679 CNC(=O)C[C@H](Cc1csc2c1cccc2)NC(=O)Cc3cccc(c3)C LN00144600_AK00442_SB0105 [0,0,0,0,0,1|3,0,0]=4 14 B29R3.143110679 Cc1cccc(c1)NC(=O)C[C@H](Cc2c[nH]c3c2cccc3)NC(=O)CO LN00146311_AG0052_SB2706 [0,0,0,0,0,1|3,0,0]=4 15 B30R3.12545362 CCC(=O)N[C@H](CC(=O)Nc1cc(cc(c1)Br)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0785_SB0064 [0,1,0,0,0,1|2,0,0]=4 16 B30R3.12545362 CCC(=O)N[C@H](CC(=O)Nc1cc(cc(c1)Cl)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1238_SB0064 [0,1,0,0,0,1|2,0,0]=4 17 B30R3.12545362 CCC(=O)N[C@H](CC(=O)Nc1cc(cc(c1)F)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1107_SB0064 [0,1,0,0,0,1|2,0,0]=4 18 B30R3.12545362 CCC(=O)N[C@H](CC(=O)Nc1cc(cc(c1)O)C)Cc2c[nH]c3c2cccc3 LN00146311_AG2086_SB0064 [0,1,0,0,0,1|2,0,0]=4 19 B30R3.12545362 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cc(cc(c3)C)C LN00146311_AK00442_SB2245 [0,1,0,0,0,1|2,0,0]=4 20 B30R3.12545362 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cc(cc(c3)F)C LN00146311_AK00442_SB3033 [0,1,0,0,0,1|2,0,0]=4 21 B30R3.30374745 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)CC)Cc2c[nH]c3c2cccc3 LN00146311_AG0525_SB0064 [0,1,0,0,0,1|2,0,0]=4 22 B30R3.30374745 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)CF)Cc2c[nH]c3c2cccc3 LN00146311_AG4045_SB0064 [0,1,0,0,0,1|2,0,0]=4 23 B30R3.30374745 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)CO)Cc2c[nH]c3c2cccc3 LN00146311_AG1149_SB0064 [0,1,0,0,0,1|2,0,0]=4 24 B30R3.30374745 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)OC)Cc2c[nH]c3c2cccc3 LN00146311_AG00177_SB0064 [0,1,0,0,0,1|2,0,0]=4 25 B30R3.30374745 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1)SC)Cc2c[nH]c3c2cccc3 LN00146311_AG0502_SB0064 [0,1,0,0,0,1|2,0,0]=4 26 B30R3.30374745 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)OC LN00146311_AK00442_SB0103 [0,1,0,0,0,1|2,0,0]=4 27 B30R3.30374745 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)SC LN00146311_AK00442_SB5356 [0,1,0,0,0,1|2,0,0]=4 28 B30R3.51298616 CC(=O)C(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB0051 [0,1,0,0,0,1|2,0,0]=4 29 B30R3.51298616 Cc1cccc(c1)CC(=O)N[C@H](CC(=O)N(C)C)Cc2c[nH]c3c2cccc3 LN00146311_AN0032_SB0105 [0,1,0,0,0,1|2,0,0]=4 30 B30R3.51298616 Cc1cccc(c1)NC(=O)C[C@H](Cc2c[nH]c3c2cccc3)NC(=O)C(C)C LN00146311_AG0052_SB0052 [0,1,0,0,0,1|2,0,0]=4 31 B30R3.51298616 Cc1cccc(c1)NC(=O)C[C@H](Cc2c[nH]c3c2cccc3)NC(=O)C(C)S LN00146311_AG0052_SB2708 [0,1,0,0,0,1|2,0,0]=4 32 B30R3.51298616 Cc1cccc(c1)NC(=O)C[C@H](Cc2c[nH]c3c2cccc3)NC(=O)[C@@H](C)O LN00146311_AG0052_SB1085 [0,1,0,0,0,1|2,0,0]=4 33 B30R3.156005098 C/C=C/C(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB0340 [0,1,0,0,0,1|2,0,0]=4 34 B30R3.156005098 CC#CC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB1240 [0,1,0,0,0,1|2,0,0]=4 35 B30R3.156005098 CCCC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB0073 [0,1,0,0,0,1|2,0,0]=4 36 B30R3.156005098 CCNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cccc(c3)C LN00146311_AK00476_SB0105 [0,1,0,0,0,1|2,0,0]=4 37 B30R3.156005098 COCC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB0090 [0,1,0,0,0,1|1,0,0]=3 38 B30R3.156005098 COCC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2csc3c2cccc3 LN00144600_AG0052_SB0090 [0,1,0,0,0,1|2,0,0]=4 39 B30R3.156005098 COCC(=O)N[C@H](CC(=O)Nc1cccc(c1)I)Cc2c[nH]c3c2cccc3 LN00146311_AG0649_SB0090 [0,1,0,0,0,1|2,0,0]=4 40 B30R3.156005098 COCC(=O)N[C@H](CC(=O)Nc1cccc(c1)O)Cc2c[nH]c3c2cccc3 LN00146311_AG00200_SB0090 [0,1,0,0,0,1|2,0,0]=4 41 B30R3.156005098 COCC(=O)N[C@H](CC(=O)Nc1cccc(n1)C)Cc2c[nH]c3c2cccc3 LN00146311_AF0019_SB0090 [0,1,0,0,0,1|2,0,0]=4 42 B30R3.156005098 COCC(=O)N[C@H](CC(=O)Nc1cncc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AF0136_SB0090 [0,1,0,0,0,1|2,0,0]=4 43 B30R3.156005098 CSCC(=O)N[C@H](CC(=O)Nc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0052_SB1267 [0,1,0,0,0,1|1,1,0]=4 44 B30R3.182966720 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1Br)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1214_SB0064 [0,1,0,0,0,1|2,0,0]=4 45 B30R3.182966720 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1C)C)Cc2c[nH]c3c2cccc3 LN00146311_AG00181_SB0064 [0,1,0,0,0,1|2,0,0]=4 46 B30R3.182966720 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1Cl)C)Cc2c[nH]c3c2cccc3 LN00146311_AG3308_SB0064 [0,1,0,0,0,1|2,0,0]=4 47 B30R3.182966720 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1F)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0551_SB0064 [0,1,0,0,0,1|2,0,0]=4 48 B30R3.182966720 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1I)C)Cc2c[nH]c3c2cccc3 LN00146311_AG3190_SB0064 [0,1,0,0,0,1|2,0,0]=4 49 B30R3.182966720 CCC(=O)N[C@H](CC(=O)Nc1cccc(c1O)C)Cc2c[nH]c3c2cccc3 LN00146311_AG0357_SB0064 [0,1,0,0,0,1|2,0,0]=4 50 B30R3.182966722 CCC(=O)N[C@H](CC(=O)Nc1ccc(c(c1)C)Br)Cc2c[nH]c3c2cccc3 LN00146311_AG1345_SB0064 [0,1,0,0,0,1|2,0,0]=4 51 B30R3.182966722 CCC(=O)N[C@H](CC(=O)Nc1ccc(c(c1)C)Cl)Cc2c[nH]c3c2cccc3 LN00146311_AG0659_SB0064 [0,1,0,0,0,1|2,0,0]=4 52 B30R3.182966722 CCC(=O)N[C@H](CC(=O)Nc1ccc(c(c1)C)F)Cc2c[nH]c3c2cccc3 LN00146311_AG0085_SB0064 [0,1,0,0,0,1|2,0,0]=4 53 B30R3.182966722 CCC(=O)N[C@H](CC(=O)Nc1ccc(c(c1)C)I)Cc2c[nH]c3c2cccc3 LN00146311_AG4115_SB0064 [0,1,0,0,0,1|2,0,0]=4 54 B30R3.182966722 CCC(=O)N[C@H](CC(=O)Nc1ccc(c(c1)C)O)Cc2c[nH]c3c2cccc3 LN00146311_AG0473_SB0064 [0,1,0,0,0,1|2,0,0]=4 55 B30R3.182966722 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3ccc(c(c3)C)C LN00146311_AK00442_SB1486 [0,1,0,0,0,1|2,0,0]=4 56 B30R3.880367567 CCC(=O)N[C@H](CC(=O)Nc1cc(ccc1Br)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1052_SB0064 [0,1,0,0,0,1|2,0,0]=4 57 B30R3.880367567 CCC(=O)N[C@H](CC(=O)Nc1cc(ccc1Cl)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1204_SB0064 [0,1,0,0,0,1|2,0,0]=4 58 B30R3.880367567 CCC(=O)N[C@H](CC(=O)Nc1cc(ccc1F)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1697_SB0064 [0,1,0,0,0,1|2,0,0]=4 59 B30R3.880367567 CCC(=O)N[C@H](CC(=O)Nc1cc(ccc1I)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1243_SB0064 [0,1,0,0,0,1|2,0,0]=4 60 B30R3.880367567 CCC(=O)N[C@H](CC(=O)Nc1cc(ccc1O)C)Cc2c[nH]c3c2cccc3 LN00146311_AG1283_SB0064 [0,1,0,0,0,1|2,0,0]=4 61 B30R3.880367567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3cc(ccc3C)C LN00146311_AK00442_SB0420 [0,1,0,0,0,1|2,0,0]=4 62 B30R4.316332848 CNC(=O)[C@@H]1Cc2c([nH]c3c2cccc3)CN1C(=O)Cc4cccc(c4)C LN00145491_AK00442_SB0105 [0,1,0,1,0,0|2,0,0]=4 63 B30R4.316332848 CNC(=O)[C@H]1Cc2c([nH]c3c2cccc3)CN1C(=O)Cc4cccc(c4)C LN00145988_AK00442_SB0105 [0,1,0,1,0,0|2,0,0]=4 64 B28R3.210431 CCC(=O)N[C@H](CC(=O)Nc1ccccc1)Cc2c[nH]c3c2cccc3 LN00146311_AG00183_SB0064 [1,0,0,0,0,1|2,0,0]=4 65 B28R3.210431 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc3ccccc3 LN00146311_AK00442_SB0092 [1,0,0,0,0,1|2,0,0]=4 66 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cc(ccn3)C LN00146311_AK00442_SC0235 [0,0,0,0,1,1|2,0,0]=4 67 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cccc(c3)Br LN00146311_AK00442_SD0041 [0,0,0,0,1,1|2,0,0]=4 68 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cccc(c3)C LN00146311_AK00442_SD0056 [0,0,0,0,1,1|1,0,0]=3 69 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cccc(c3)Cl LN00146311_AK00442_SD0045 [0,0,0,0,1,1|2,0,0]=4 70 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cccc(c3)F LN00146311_AK00442_SD0043 [0,0,0,0,1,1|2,0,0]=4 71 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cccc(c3)I LN00146311_AK00442_SD0405 [0,0,0,0,1,1|2,0,0]=4 72 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cccc(c3)O LN00146311_AK00442_SD1724 [0,0,0,0,1,1|2,0,0]=4 73 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3ccnc(c3)C LN00146311_AK00442_SC0400 [0,0,0,0,1,1|2,0,0]=4 74 B28R3.8288567 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)c3cncc(c3)C LN00146311_AK00442_SC0095 [0,0,0,0,1,1|2,0,0]=4 75 B28R3.8288567 CNC(=O)C[C@H](Cc1csc2c1cccc2)NC(=O)c3cccc(c3)C LN00144600_AK00442_SD0056 [0,0,0,0,1,1|2,0,0]=4 76 B30R3.182968818 CCC(=O)N[C@H](CC(=O)NCc1cccc(c1)C)Cc2c[nH]c3c2cccc3 LN00146311_AK0045_SB0064 [0,0,0,0,0,2|2,0,0]=4 77 B30R3.182968818 CNC(=O)C[C@H](Cc1c[nH]c2c1cccc2)NC(=O)CCc3cccc(c3)C LN00146311_AK00442_SB1394 [0,0,0,0,0,2|2,0,0]=4