0 B21R2.14189985 CC(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C c8372c1ee89c6c1f755ad59ecbd64452 [0,0,0,0,0,0|2,0,1]=3 1 B20R2.2671397 CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C 25c3c2db455e88321bd3b4fea8c68ebe [1,0,0,0,0,0|1,0,1]=3 2 B20R2.2671397 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC#N 8350e42ee7d963f61205463cb26bb2d5 [1,0,0,0,0,0|2,0,1]=4 3 B20R2.2671397 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCF c09693381c1ad6516c98e41adf426454 [1,0,0,0,0,0|2,0,1]=4 4 B22R2.8355619 C#CC(C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C f85eb6f4b2d426f6af8a7cf241afec91 [0,1,0,0,0,0|2,0,1]=4 5 B22R2.8355619 C#CC(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 786760f0a2eb2fcd336ffe66792f4ef8 [0,1,0,0,0,0|2,0,1]=4 6 B22R2.8355619 C#C[C@@H](C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 36fa01f83724f061c40fba88b835410c [0,1,0,0,0,0|2,0,1]=4 7 B22R2.8355619 C#C[C@@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C f3a5dd8cdf7f4fc840e55e1f5c8c4f5a [0,1,0,0,0,0|2,0,1]=4 8 B22R2.8355619 C#C[C@H](C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 09f46760222177d94d5d72a54e2733dd [0,1,0,0,0,0|2,0,1]=4 9 B22R2.8355619 C#C[C@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 8637a6a0f91abfa6f321f09ef8c50b2e [0,1,0,0,0,0|2,0,1]=4 10 B22R2.8355619 C=C(C=O)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 8423c455dcbb5eee35162316a1474540 [0,1,0,0,0,0|1,0,1]=3 11 B22R2.8355619 C=CC(C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 39470ad78e1c3e28e30d2765bf55da79 [0,1,0,0,0,0|2,0,1]=4 12 B22R2.8355619 C=CC(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 7d2a83546052319ba8da3138a3a801dd [0,1,0,0,0,0|2,0,1]=4 13 B22R2.8355619 C=C[C@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 43e1a955662e453d57eed12b3c74029f [0,1,0,0,0,0|2,0,1]=4 14 B22R2.8355619 CC(C#N)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 9252a6b0ea4153450bdaeb8eeaeebe27 [0,1,0,0,0,0|2,0,1]=4 15 B22R2.8355619 CC(C=O)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 953af86ac85089b1eeecbedf94e056ba [0,1,0,0,0,0|1,0,1]=3 16 B22R2.8355619 CC(CF)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 9a80b82b95a861b29a9451b40000d068 [0,1,0,0,0,0|2,0,1]=4 17 B22R2.8355619 CC(CO)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5340f778f80d6529e9266daf3aaf95f8 [0,1,0,0,0,0|1,0,2]=4 18 B22R2.8355619 CCC(C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 3070ab4b90be7c3699d3f3ff746e9f98 [0,1,0,0,0,0|2,0,1]=4 19 B22R2.8355619 CCC(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 3b6ff518ffc56264c593629728e90eef [0,1,0,0,0,0|2,0,1]=4 20 B22R2.8355619 CC[C@@H](C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C dd52eb4640d29f228602ff652b4b991d [0,1,0,0,0,0|2,0,1]=4 21 B22R2.8355619 CC[C@@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 336cfa53712f0230c5f6a7967f3150ac [0,1,0,0,0,0|2,0,1]=4 22 B22R2.8355619 CC[C@H](C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 49b3b1b9d8d7ef987abb1c607064a6e7 [0,1,0,0,0,0|2,0,1]=4 23 B22R2.8355619 CC[C@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 4116b843ca2a7e82ee76a46d3be920be [0,1,0,0,0,0|2,0,1]=4 24 B22R2.8355619 C[C@@H](CO)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 7443f47951c2999a9137f045678d27d8 [0,1,0,0,0,0|1,0,2]=4 25 B22R2.8355619 C[C@H](C=O)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 610e5326f02ae4c898128b42216ed67d [0,1,0,0,0,0|1,0,1]=3 26 B22R2.8355619 C[C@H](CO)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 691bf891492972f35069fa40eadc511f [0,1,0,0,0,0|1,0,2]=4 27 B22R2.23904717 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC(C)(C)C d983de687357fde633acc0220343f05b [0,1,0,0,0,0|2,0,1]=4 28 B22R3.51367257 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC3CC3 10a800450c529a6ed577dcaf72a14e04 [0,0,0,1,0,0|2,0,1]=4 29 B22R3.51367257 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOC3CC3 6ae2e526af6377f3ccb0f476ccb971e4 [0,0,0,1,0,0|2,0,1]=4 30 B22R2.23904716 C=C(Br)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C f6c8257a7152f8be469a31569523bf9a [0,0,0,0,0,1|1,0,1]=3 31 B22R2.23904716 C=C(Br)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C cfdb351bf8f41d51a3df21d0f1be0572 [0,0,0,0,0,1|1,0,1]=3 32 B22R2.23904716 C=C(C)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 6782867d60971385dfe870d81c8de430 [0,0,0,0,0,1|1,0,0]=2 33 B22R2.23904716 C=C(C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 195256e5961a702bbc1940b80d7348f4 [0,0,0,0,0,1|1,0,0]=2 34 B22R2.23904716 C=C(Cl)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 170f603ca37012bfbe10d579640fb2b9 [0,0,0,0,0,1|1,0,1]=3 35 B22R2.23904716 C=C(F)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C bdef5f9ca12bce28dc7d55fc5f4569d7 [0,0,0,0,0,1|1,0,1]=3 36 B22R2.23904716 CC(=O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C c12322990ea142716c1150bc34d5917c [0,0,0,0,0,1|0,0,0]=1 37 B22R2.23904716 CC(=O)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C aaba2de6a40f76be8b32f1ad6aa88e2f [0,0,0,0,0,1|0,0,0]=1 38 B22R2.23904716 CC(C)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 208fbe32d598550b0658f34e3d8ab713 [0,0,0,0,0,1|1,0,1]=3 39 B22R2.23904716 CC(C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C c02dea5ffc17e7f8974a4f121d94bbe5 [0,0,0,0,0,1|1,0,1]=3 40 B22R2.23904716 CC(F)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 58d525d2f959c0cb43eba43b9c650651 [0,0,0,0,0,1|1,0,1]=3 41 B22R2.23904716 CC(O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 0837e9e59c12b0b948bd84cf7035d512 [0,0,0,0,0,1|0,0,2]=3 42 B22R2.23904716 CN(C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C cd595a13fbd69d9846ea5ee516f4705b [0,0,0,0,0,1|2,0,0]=3 43 B22R2.23904716 C[C@@H](F)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C ad95804a2f313a596618a68700498449 [0,0,0,0,0,1|1,0,1]=3 44 B22R2.23904716 C[C@@H](O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 1d1e1854a76acf508ce6659af63e6025 [0,0,0,0,0,1|0,0,2]=3 45 B22R2.23904716 C[C@H](F)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 8511f2e0de7d1145b2db465409c3e620 [0,0,0,0,0,1|1,0,1]=3 46 B22R2.23904716 C[C@H](O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 7a85143902545516c43e2a0016d5943d [0,0,0,0,0,1|0,0,2]=3 47 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(=O)N eab59439e37ee1eb61adbdd1fe4590f8 [0,0,0,0,0,1|1,0,0]=2 48 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(F)F cfa94bc3e3f67f3e1bc167e8a3219eb3 [0,0,0,0,0,1|2,0,1]=4 49 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(=O)N 65497ad0c6cb93b2410283c09e64767a [0,0,0,0,0,1|1,0,0]=2 50 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(=O)O f7af8c65b36e2b7086cd138d1b99aefa [0,0,0,0,0,1|1,0,0]=2 51 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(F)F 5c0a22a4ee703cb9944cf9392e062bec [0,0,0,0,0,1|2,0,1]=4 52 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCS(=O)O dee1067fb2121de51fe625cf2ff901c5 [0,0,0,0,0,1|2,0,0]=3 53 B22R2.23904716 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOC[N+](=O)[O-] c286161cd1b3e0099623210df7fadf90 [0,0,0,0,0,1|2,0,0]=3 54 B21R2.1129572 CCN(C)CCCn1c(=O)c2c(ncn2C)n(c1=O)C afc7e648611b01cf2b5d0325132b18de [1,1,0,0,0,0|1,0,1]=4 55 B21R2.2598734 C#CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C f7381c21623a53e586499213e1872bfe [1,1,0,0,0,0|0,0,2]=4 56 B21R2.2598734 C#CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5ce896e65233b6185a0379205c151eba [1,1,0,0,0,0|0,0,2]=4 57 B21R2.2598734 C=CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C e6309f39ced9b2625191b30d68e1767a [1,1,0,0,0,0|0,0,1]=3 58 B21R2.2598734 CCCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C d44d57beb878a7f8ae1e7abdbd9031c1 [1,1,0,0,0,0|0,0,1]=3 59 B21R2.2598734 CCCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C 856dcaecccd25a5cc8c8e9d5ee61ed45 [1,1,0,0,0,0|0,0,1]=3 60 B21R2.2598734 COCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C 39ab022dd9f76b3714edd2a22f4f6614 [1,1,0,0,0,0|1,0,0]=3 61 B21R2.2598734 CSCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C e2af53dec7aeb5a17eb22aa4b27578b2 [1,1,0,0,0,0|1,0,0]=3 62 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC#N 9f8c93d1c0c5caba0cd9c02817b99f36 [1,1,0,0,0,0|1,0,1]=4 63 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCBr 0c23f17e9b148e6c847415dcc98141c7 [1,1,0,0,0,0|1,0,1]=4 64 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCF 74b69686cf2ac55cacc0c370f1003dcb [1,1,0,0,0,0|1,0,1]=4 65 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCI 6febfe905fae57f7384ec7602798eb2b [1,1,0,0,0,0|1,0,1]=4 66 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCO f35964018eb02bc25513d717d1d829b2 [1,1,0,0,0,0|0,0,2]=4 67 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCS 276d40a8c1404f480587f53607208e9f [1,1,0,0,0,0|0,1,1]=4 68 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC#N 1eab4ee5e1a4bbd1fbc4c56c1e4377a2 [1,1,0,0,0,0|1,0,1]=4 69 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC=O 1cfe004a382098fc1980be4f7dfccad8 [1,1,0,0,0,0|0,0,0]=2 70 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCCF 28e9213cf88c308e4dfaf18e5cfe274f [1,1,0,0,0,0|1,0,1]=4 71 B21R2.2598734 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCCS ac8ce6bee1e1dbaed3823ab3bcd93c2b [1,1,0,0,0,0|0,1,1]=4 72 B23R2.12044479 C/C(=C\I)/COCCCn1c(=O)c2c(ncn2C)n(c1=O)C f2ad0149161dcfe9fdb2e1e982e9a488 [0,1,0,0,0,1|1,0,0]=3 73 B23R2.12044479 C=C(C#N)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 466ed68730712bc412291bb0aa2ca06b [0,1,0,0,0,1|1,0,1]=4 74 B23R2.12044479 C=C(CC)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C d216d957326146f2f2e9eb6cae0fa3eb [0,1,0,0,0,1|1,0,0]=3 75 B23R2.12044479 C=C(COCCCn1c(=O)c2c(ncn2C)n(c1=O)C)OC 5e6d9dd8abee051d9302343d10e8e026 [0,1,0,0,0,1|1,0,0]=3 76 B23R2.12044479 C=CC(C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 51376779dbabf355f9396ebef56b8e3a [0,1,0,0,0,1|1,0,1]=4 77 B23R2.12044479 CC(=CI)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 041d45fc9931b88ace3353b58d34433f [0,1,0,0,0,1|1,0,0]=3 78 B23R2.12044479 CC(C#N)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C e34ea8ba2918805151069dade83b7e74 [0,1,0,0,0,1|1,0,1]=4 79 B23R2.12044479 CC(C#N)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 09679ecb415f4887fc19ceef30e1fbf3 [0,1,0,0,0,1|1,0,1]=4 80 B23R2.12044479 CC(CO)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 88b672bb6022c69c0674c4ebbb5c1757 [0,1,0,0,0,1|0,0,2]=4 81 B23R2.12044479 CCC(=O)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C cc35ca9edc940d363b117e2fd706dcbb [0,1,0,0,0,1|0,0,0]=2 82 B23R2.12044479 CCC(C)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 14d63021dac9deafd41edb5ed83074ba [0,1,0,0,0,1|1,0,1]=4 83 B23R2.12044479 CCC(C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C d6a72327808a2831eb3eaa33b4ab7041 [0,1,0,0,0,1|1,0,1]=4 84 B23R2.12044479 CCC(O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C ec7ea6a3dc91158c592ee758865931b2 [0,1,0,0,0,1|0,0,2]=4 85 B23R2.12044479 CC[C@@H](C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C a00371d8ae416fe29c67a7163d3a44a4 [0,1,0,0,0,1|1,0,1]=4 86 B23R2.12044479 CC[C@@H](O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 36e29cbc1b8c3304e43d727fe27855e6 [0,1,0,0,0,1|0,0,2]=4 87 B23R2.12044479 CC[C@H](C)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C d3ede2f69d981e82759beb79eb5a4963 [0,1,0,0,0,1|1,0,1]=4 88 B23R2.12044479 CC[C@H](C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 6a3f6c185c65b0f6029b16f21beca426 [0,1,0,0,0,1|1,0,1]=4 89 B23R2.12044479 CNC(=O)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 7985cfa5fd0c4934cd6563b7cfa937d4 [0,1,0,0,0,1|0,0,0]=2 90 B23R2.12044479 CNC(=O)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C fc641b56446e388adab5420bce3f2ca7 [0,1,0,0,0,1|0,0,0]=2 91 B23R2.12044479 COC(=O)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 48f9b1542e16b107100a1450feeb6420 [0,1,0,0,0,1|0,0,0]=2 92 B23R2.12044479 COC(C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 2a2ed2c9993d1912c80ba6aaec02556c [0,1,0,0,0,1|0,0,2]=4 93 B23R2.12044479 CO[C@@H](C)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 03f969a53ce4187dcfe3bd0792ee13ce [0,1,0,0,0,1|0,0,2]=4 94 B23R2.12044479 CO[C@@H](C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C a9a4ab4816f820742abf352af016b08a [0,1,0,0,0,1|0,0,2]=4 95 B23R2.12044479 CO[C@H](C)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 2b96a809dc9dd90edb860471ba2548ec [0,1,0,0,0,1|0,0,2]=4 96 B23R2.12044479 CO[C@H](C)COCCCn1c(=O)c2c(ncn2C)n(c1=O)C 3a4f3339b80567a5fdeabf9dc317cc5d [0,1,0,0,0,1|0,0,2]=4 97 B23R2.12044479 C[C@H](CO)CNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 75f9f7a6192971184a26ef39c70a853a [0,1,0,0,0,1|0,0,2]=4 98 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(=O)NO 22935e5d8b96f73e0e8472e032d16a81 [0,1,0,0,0,1|1,0,0]=3 99 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(Br)CBr 80e979d123ff8df71ae99c6ff0328eb9 [0,1,0,0,0,1|1,0,1]=4 100 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(F)CO 14870d28d1bb1eb8fde692e92f78a604 [0,1,0,0,0,1|1,0,1]=4 101 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(O)CO 4f774171df49938d93efd46504afd780 [0,1,0,0,0,1|0,0,2]=4 102 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC[C@@H](F)CO f6c184aab37827fb1b0afe98e65c7191 [0,1,0,0,0,1|1,0,1]=4 103 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC[C@@H](O)CO 1d82de9142afd712b73cf0d2d2e8d664 [0,1,0,0,0,1|0,0,2]=4 104 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC[C@H](F)CO 2aeec561dd2416d8a8e03a6ae76b325c [0,1,0,0,0,1|1,0,1]=4 105 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC[C@H](O)CO 851a7784b54b5256498290a6767aa41e [0,1,0,0,0,1|0,0,2]=4 106 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOC/C(=C/Cl)/Cl 41b3bec1048f3e9f8faa2853de1c15e0 [0,1,0,0,0,1|1,0,1]=4 107 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(O)CO 2b810baf26d2a1cf80725265066816bc [0,1,0,0,0,1|0,0,2]=4 108 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(S)CS 1967fbdc7ba15c796b2db34b0c188c47 [0,1,0,0,0,1|0,1,1]=4 109 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOC[C@@H](O)CO dc20ed776c5368f3125e1f0ec7f37c8e [0,1,0,0,0,1|0,0,2]=4 110 B23R2.12044479 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOC[C@H](O)CO c2f241bcd605996329e5093d2af5c7b8 [0,1,0,0,0,1|0,0,2]=4 111 B23R2.39379670 CC(=O)C(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 15af73bf60b4e0a55a355727c1637111 [0,1,0,0,0,1|0,0,0]=2 112 B23R2.39379670 CC(C)C(C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 895ea004d960aee3dbd9a0f73c3d8e8d [0,1,0,0,0,1|1,0,1]=4 113 B23R2.39379670 CC(C)C(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5e2826cfc270413f193daa8e80f55499 [0,1,0,0,0,1|1,0,1]=4 114 B23R2.39379670 CC(C)[C@@H](C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 7dcd791c6ed1656d269290a7829d960f [0,1,0,0,0,1|1,0,1]=4 115 B23R2.39379670 CC(C)[C@@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 84e09d7fd7b16f070f6826a4d5768e6e [0,1,0,0,0,1|1,0,1]=4 116 B23R2.39379670 CC(C)[C@H](C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C e509026a285ef162cfafd12ef038f289 [0,1,0,0,0,1|1,0,1]=4 117 B23R2.39379670 CC(C)[C@H](C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C de330a4e6b9ffd5c37e3f3a2eecd9d6c [0,1,0,0,0,1|1,0,1]=4 118 B23R2.39379670 CC(NCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)N 4aaba543043474e8d3e313ecf1ae098a [0,1,0,0,0,1|1,0,0]=3 119 B23R2.39379670 CC(NCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)O a4893e1a21e81c46246426945d6a1c63 [0,1,0,0,0,1|1,0,0]=3 120 B23R2.39379670 CC(O)C(C)NCCCn1c(=O)c2c(ncn2C)n(c1=O)C 42fefd9103035fffb9b749cef5e7088f [0,1,0,0,0,1|0,0,2]=4 121 B23R2.39379670 CC(OCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)N 9dc0895dd57c6a645a8534fe15d2a31c [0,1,0,0,0,1|1,0,0]=3 122 B23R2.39379670 CC(S)C(C)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C 90c7c43e7f139732b5d6b1de118387f3 [0,1,0,0,0,1|0,1,1]=4 123 B23R2.39379670 C[C@@H](NCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)N 429d42036a169c42c8243db2ed35afa3 [0,1,0,0,0,1|1,0,0]=3 124 B23R2.39379670 C[C@@H](NCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)O a3ce373bb903610a8ede376b7a5b41d9 [0,1,0,0,0,1|1,0,0]=3 125 B23R2.39379670 C[C@@H](OCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)N 5326f034989178051825ecfc68cedd2c [0,1,0,0,0,1|1,0,0]=3 126 B23R2.39379670 C[C@H](NCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)N 6a81d56199ccc24de75f480cebca2b09 [0,1,0,0,0,1|1,0,0]=3 127 B23R2.39379670 C[C@H](NCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)O 27879d1a3050c8835953cd20d99d7055 [0,1,0,0,0,1|1,0,0]=3 128 B23R2.39379670 C[C@H](OCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C(=O)N 4b66cea60baf3754137479b14ddd1cab [0,1,0,0,0,1|1,0,0]=3 129 B23R2.39379670 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNC(O)C(=O)O 0b19c741633c0ff394cf39e714f9b78b [0,1,0,0,0,1|1,0,0]=3 130 B23R2.39379670 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOC(F)C(=O)N f33702168c365c4c27921401311fdec4 [0,1,0,0,0,1|1,0,0]=3 131 B23R2.39379681 CC(C)CN(C)CCCn1c(=O)c2c(ncn2C)n(c1=O)C 9d5cdd159b088a483e04a9092cc8a319 [0,1,0,0,0,1|1,0,1]=4 132 B23R2.39379681 CC(O)CN(C)CCCn1c(=O)c2c(ncn2C)n(c1=O)C 08375a88d5ccd9f51dd1bfe2f040583f [0,1,0,0,0,1|0,0,2]=4 133 B23R2.39379681 CN(CCCn1c(=O)c2c(ncn2C)n(c1=O)C)CC(=O)N 3da3d3c9fa6f7b25f9e5dee50e18e168 [0,1,0,0,0,1|1,0,0]=3 134 B23R2.39379681 C[C@H](O)CN(C)CCCn1c(=O)c2c(ncn2C)n(c1=O)C 7b024152ce19ccf7db2b31212e850a93 [0,1,0,0,0,1|0,0,2]=4 135 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(C)(C)C 4e3f60b51f0c526c976c999cd297ecdd [0,1,0,0,0,1|1,0,1]=4 136 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(C)(C)O 310c8ee843bd4fffc39de281d7d951e4 [0,1,0,0,0,1|0,0,2]=4 137 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC(C)(F)F bf65ca23c8c81f91f73a60992036fbe3 [0,1,0,0,0,1|1,0,1]=4 138 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCS(=O)(=O)O 0e570ce308dfb56ab27b841e4118d63d [0,1,0,0,0,1|2,0,0]=4 139 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(C)(C)Br 13a34d90bd3ccccbc68fb052de5ddc15 [0,1,0,0,0,1|1,0,1]=4 140 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(C)(C)C 4e8adc4a704e5bb6523fc591862e0ce1 [0,1,0,0,0,1|1,0,1]=4 141 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(C)(C)F d170e7ee627152f74da411f03c22eda5 [0,1,0,0,0,1|1,0,1]=4 142 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(C)(C)O 813f765446bf025fcf4feda71c12a02b [0,1,0,0,0,1|0,0,2]=4 143 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(C)(C)S ec59610fdc2eac7df1b2d578bbd6cffa [0,1,0,0,0,1|0,1,1]=4 144 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC(C)(F)F fdc8392960dbf5f8deb4fb4f510dc3da [0,1,0,0,0,1|1,0,1]=4 145 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCS(=O)(=O)C 220b32360a1de9bf85dbf4e30ad4b36d [0,1,0,0,0,1|1,0,0]=3 146 B23R2.39379685 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCS(=O)(=O)O 0ecf1ab521986052e69ff20d169f7ae4 [0,1,0,0,0,1|2,0,0]=4 147 B23R2.8610033 CCC(C=O)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C edae7790a7decafb24d6edaf50ac25a2 [0,2,0,0,0,0|1,0,1]=4 148 B23R2.10404334 CC(CCCCn1c(=O)c2c(ncn2C)n(c1=O)C)OCF eaca0ab22f99c707107b716fea3b5bab [0,2,0,0,0,0|0,0,2]=4 149 B23R2.10404334 CCCC(=S)OCCCn1c(=O)c2c(ncn2C)n(c1=O)C a6e39a31c8b225cf939f07805f324a52 [0,2,0,0,0,0|1,1,0]=4 150 B23R2.10404334 CCOC(C)CCCCn1c(=O)c2c(ncn2C)n(c1=O)C 0da9c7b8f9446c4d8dc42076d900d71a [0,2,0,0,0,0|0,0,2]=4 151 B23R2.10404334 CCO[C@@H](C)CCCCn1c(=O)c2c(ncn2C)n(c1=O)C e7b5bd368f31ebbf0e5993c2cafd1d51 [0,2,0,0,0,0|0,0,2]=4 152 B23R2.10404334 CCO[C@H](C)CCCCn1c(=O)c2c(ncn2C)n(c1=O)C ba75b6759167f01f95e096ab08d2203c [0,2,0,0,0,0|0,0,2]=4 153 B23R2.10404334 C[C@@H](CCCCn1c(=O)c2c(ncn2C)n(c1=O)C)OCF 1fb7bc453fb3919feb33a5422f574a2f [0,2,0,0,0,0|0,0,2]=4 154 B23R2.10404334 C[C@H](CCCCn1c(=O)c2c(ncn2C)n(c1=O)C)OCF 19f835b902b85c4546da5c9a25012146 [0,2,0,0,0,0|0,0,2]=4 155 B23R2.10404334 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCCC(=O)NC#N ec4ea247f680bcadb935d7875c686645 [0,2,0,0,0,0|0,0,1]=3 156 B23R3.91006801 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCC3CC3 2b8d015002514bea7da41f424d6ef71c [0,0,0,1,0,1|1,0,1]=4 157 B23R3.91006801 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC3CC3 1f4a05f4af86e5f2315bdb813d0ebce9 [0,0,0,1,0,1|1,0,1]=4 158 B23R3.91007157 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCN3CC3(C)C 140cdc9774ebd5748486755d50faab76 [0,0,0,1,0,1|1,0,1]=4 159 B23R3.480467850 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCN3CC(C3)O 425d6114c011a4d40b63de86d42f0d8c [0,0,0,1,0,1|0,0,2]=4 160 B23R3.480467852 CC1CC1NCCCn2c(=O)c3c(ncn3C)n(c2=O)C 09b25dff8445e9dbd7e7b35df12278f5 [0,0,0,1,0,1|1,0,1]=4 161 B23R3.480467852 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCN[C@@H]3C[C@H]3F 0d04faa8b7c873d240699cbc84e37d3a [0,0,0,1,0,1|1,0,1]=4 162 B23R3.480467852 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCN[C@H]3C[C@@H]3F 2934a96cbae17a7ffa90b5c2ef02c782 [0,0,0,1,0,1|1,0,1]=4 163 B23R3.480467852 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCN[C@H]3C[C@H]3F 452352682e873969e7d0571120463dc4 [0,0,0,1,0,1|1,0,1]=4 164 B23R2.39379684 C/C(=C/COCCCn1c(=O)c2c(ncn2C)n(c1=O)C)/Cl 5c9ccc43d10aade5332e8fadee97aaff [0,0,0,0,0,2|1,0,0]=3 165 B23R2.39379684 C/C(=C/COCCCn1c(=O)c2c(ncn2C)n(c1=O)C)/I 8b85ec5eeac268b251e52e0b3b27e4d0 [0,0,0,0,0,2|1,0,0]=3 166 B23R2.39379684 C/C(=C\COCCCn1c(=O)c2c(ncn2C)n(c1=O)C)/Cl 713a63ef0b45da14f407742740a659a7 [0,0,0,0,0,2|1,0,0]=3 167 B23R2.39379684 C=C(C)CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C ff330b9852770327fee17b8e6ec357ad [0,0,0,0,0,2|1,0,0]=3 168 B23R2.39379684 C=C(C)CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C cc021651570a2e692fcb45ef7f0196f0 [0,0,0,0,0,2|1,0,0]=3 169 B23R2.39379684 CC(=CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C 4b3b3f30d57449e4919f7c4cc5fb4aee [0,0,0,0,0,2|1,0,0]=3 170 B23R2.39379684 CC(=CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C)C fd4751e818ffee15681b8023cdb80520 [0,0,0,0,0,2|1,0,0]=3 171 B23R2.39379684 CC(=CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C)Cl 50b41829c1fa41db007e8ae2f9d0e2ec [0,0,0,0,0,2|1,0,0]=3 172 B23R2.39379684 CC(=CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C)I 83e3828a3f297480f4fa66b1ccf13aea [0,0,0,0,0,2|1,0,0]=3 173 B23R2.39379684 CC(=O)CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5c32a8a0aacfd8bfec382f4e283599be [0,0,0,0,0,2|0,0,0]=2 174 B23R2.39379684 CC(=O)NCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C cfbf3cc8cebea356553c73fac88a039b [0,0,0,0,0,2|0,0,0]=2 175 B23R2.39379684 CC(=O)OCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C ab1ee9cee99089fe9eb1be2fc484ee46 [0,0,0,0,0,2|0,0,0]=2 176 B23R2.39379684 CC(C)CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5496d532de9df3eba94a2ab879a35059 [0,0,0,0,0,2|1,0,1]=4 177 B23R2.39379684 CC(C)CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C 88f2bcbcf28bf1fef18e7880390841ea [0,0,0,0,0,2|1,0,1]=4 178 B23R2.39379684 CC(C)OCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C b2c88669369ef5622440e236682a0fec [0,0,0,0,0,2|1,0,1]=4 179 B23R2.39379684 CC(O)CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5ee748bd3bbc5d2060f19b7e55bb9bdb [0,0,0,0,0,2|0,0,2]=4 180 B23R2.39379684 CN(C)CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 5ee54db7bc75644d4aec5b7a903e2f53 [0,0,0,0,0,2|2,0,0]=4 181 B23R2.39379684 CN(C)CCOCCCn1c(=O)c2c(ncn2C)n(c1=O)C d874cd997312c8fae473c3c6debe57d4 [0,0,0,0,0,2|2,0,0]=4 182 B23R2.39379684 C[C@@H](O)CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 43319cd25322755ced4460bb4383c16b [0,0,0,0,0,2|0,0,2]=4 183 B23R2.39379684 C[C@H](O)CCNCCCn1c(=O)c2c(ncn2C)n(c1=O)C 43669c1f78ed64d831d2c537ba4eeb97 [0,0,0,0,0,2|0,0,2]=4 184 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCC(=O)N c7b4247b3d6dff48d2dfe11678ce0f53 [0,0,0,0,0,2|1,0,0]=3 185 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCNCCC(=S)N e989871420bf0d2d8e23d1e1b2c5d2b7 [0,0,0,0,0,2|1,1,0]=4 186 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC=C(Cl)Cl 1265c98f5574ab7dce0d8cb7092a0de8 [0,0,0,0,0,2|2,0,0]=4 187 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCCC(=O)N ade19a098be5ca1d3cb08df286ec2296 [0,0,0,0,0,2|1,0,0]=3 188 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCCS(=O)C fe9ee9b766a9874843f46ceb2238aaea [0,0,0,0,0,2|1,0,0]=3 189 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCC[N+](=O)[O-] 7e0a0733f6b42da7bffd33dd700979c8 [0,0,0,0,0,2|2,0,0]=4 190 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCNC(=O)N 7acceb0192a2adb61c3cf7e8d6906095 [0,0,0,0,0,2|1,0,0]=3 191 B23R2.39379684 Cn1cnc2c1c(=O)n(c(=O)n2C)CCCOCSC(=O)N 06b73b3e64bef0e4fc72bae68066ec95 [0,0,0,0,0,2|1,0,0]=3