0 B18R2.2431 CCCCCN(c1nccs1)C2CCCCC2 0491e1e018c59ce4931d20086338212b [0,0,1,0,0,0|3,0,0]=4 1 B18R2.2431 CCCNCC(c1ccco1)N2CCOCC2 26c5ff6c8badd1c3903424a6c4c75507 [0,0,1,0,0,0|2,1,0]=4 2 B18R2.36420 CCCCCOC1(CCCCC1)c2ccoc2 ec3da93d9f08de3ef0a2ef2783ab78bb [0,0,1,0,0,0|3,0,0]=4 3 B18R2.36420 CCCCNCC1(CCOCC1)c2cccs2 90cc0756d70ee0e87bc5bf2891516b10 [0,0,1,0,0,0|3,0,0]=4 4 B18R2.36420 CCCCOCC1(CCOCC1)c2cccs2 864a39ccf4917cd60fe336799d1ea4d9 [0,0,1,0,0,0|3,0,0]=4 5 B18R2.36420 COCCNCC1(CCCCC1)c2cccs2 6e04b01964f477df291c1e7471827531 [0,0,1,0,0,0|3,0,0]=4 6 B18R2.122518 C=CCNCC1(CCCCC1)N2CCCCC2 323880a4f253fc29b788918150e2e170 [0,0,1,0,0,0|1,0,2]=4 7 B17R2.74044 CCCNCC1(CCOCC1)c2cccs2 ba064b596b884596753e2210400feecc [1,0,1,0,0,0|2,0,0]=4 8 B17R2.74044 CCCOCC1(CCOCC1)c2cccs2 a860a76cbe23a2c0126906ad6ce1adb7 [1,0,1,0,0,0|2,0,0]=4 9 B17R2.74044 COCNCC1(CCCCC1)c2cccs2 5f87359679f4751de36923b1347a031f [1,0,1,0,0,0|2,0,0]=4 10 B17R2.74044 OCCNCC1(CCCCC1)c2cccs2 d32a532dbaf67bb4d955424e05bd8c30 [1,0,1,0,0,0|2,0,0]=4 11 B19R2.2476 CCCNCC(c1cccs1)N2CCN(CC2)C ec018e79b625ae2f756a2fd690d777d6 [0,1,1,0,0,0|2,0,0]=4 12 B19R2.3972 CCCCNCC(c1ccco1)N2CCOCC2 9c580a00ef94734576fc23f65df1df5a [0,1,1,0,0,0|1,1,0]=4 13 B19R2.57794 CCCCCOC1(CCOCC1)c2ccc(s2)C d4a0ef067f3cb49a26032dd1a23aa75a [0,1,1,0,0,0|2,0,0]=4 14 B19R2.57794 CCCCCOC1(CCOCC1)c2ccc(s2)Cl ee20a35bb86b79dfb20fd38f385a1c7f [0,1,1,0,0,0|2,0,0]=4 15 B19R2.1020234 CC(O)CCNCC1(CCCCC1)c2cccs2 ccce10542b04922a3892aadb3028dfaf [0,1,1,0,0,0|2,0,0]=4 16 B19R2.1405560 CCC(C)CNCC1(CCCCC1)c2cccs2 6fb94b9dbc9c5abe38b98b021b41231b [0,1,1,0,0,0|2,0,0]=4 17 B19R2.1405560 CC[C@H](C)CNCC1(CCCCC1)c2cccs2 2e94865c3aa30db44b974b1eecfa7c5b [0,1,1,0,0,0|2,0,0]=4 18 B19R2.1655553 C#CCCCNCC1(CCCCC1)c2cccs2 c11978c8e41aea3a721e66b0e1a234d1 [0,1,1,0,0,0|0,0,2]=4 19 B19R2.1655553 C=CCCCNCC1(CCCCC1)c2cccs2 2b367e682fb020efea71714bcd3bc0e5 [0,1,1,0,0,0|0,0,2]=4 20 B19R2.1655553 CC/C=C/CNCC1(CCCCC1)c2cccs2 0ec599b9ef2a94a512cb374429996edb [0,1,1,0,0,0|0,0,2]=4 21 B19R2.1655553 CCCCCOCC1(CCOCC1)c2cccs2 ad1b00782b79a52d228dabeb60a77c9a [0,1,1,0,0,0|2,0,0]=4 22 B19R2.1655553 CCOCCNCC1(CCOCC1)c2cccs2 a163ecfbeb7add308493dcc36393a6af [0,1,1,0,0,0|2,0,0]=4 23 B19R2.1655553 COCCCNCC1(CCCCC1)c2cccs2 38143a35ca2a8a4caecad9e2e3ece83b [0,1,1,0,0,0|1,0,0]=3 24 B19R2.1655553 COCCCNCC1(CCOCC1)c2cccs2 09fffd2ff2e1296037a154d1cac1227a [0,1,1,0,0,0|2,0,0]=4 25 B19R2.1655553 CSCCCNCC1(CCCCC1)c2cccs2 0ab533f1af43696d8e07c8026fb359c5 [0,1,1,0,0,0|1,0,0]=3 26 B19R2.1655553 CSCCCNCC1(CCOCC1)c2cccs2 d905e5e16a6c71dfb97e8fda8c828b4d [0,1,1,0,0,0|2,0,0]=4 27 B19R2.1655553 N#CCCCNCC1(CCCCC1)c2cccs2 ea81ed4a36453bfc095a3ee9bd7c8a23 [0,1,1,0,0,0|1,0,1]=4 28 B19R2.1655553 O=CCCCNCC1(CCCCC1)c2cccs2 70971a1f79493bf7ff29e3d663d297fb [0,1,1,0,0,0|1,0,1]=4 29 B19R2.166038 C=CC(=O)NCC1(CCCCC1)N2CCCCC2 77916753a10a21067ff1dae22a2c8e42 [0,1,1,0,0,0|1,0,1]=4 30 B19R3.10961 CCCN1CCc2[nH]cnc2C13CCCCC3 35c40eb531a04c98320c67a0f066f58f [0,0,1,1,0,0|2,0,0]=4 31 B19R3.10961 CCCN1CCn2cccc2C13CCCCC3 c743b933a2ce2e61bb773d48a33951d4 [0,0,1,1,0,0|1,0,0]=3 32 B19R3.10961 COCN1CCn2cccc2C13CCCCC3 b6a137dbc8898f998af80e612d0a792e [0,0,1,1,0,0|2,0,0]=4 33 B19R3.10961 CSCN1CCn2cccc2C13CCCCC3 48378186779f156cc04bf5c49d83702a [0,0,1,1,0,0|2,0,0]=4 34 B19R3.10961 FCCN1CCn2cccc2C13CCCCC3 5533594a34c688508f037a68f63fdc22 [0,0,1,1,0,0|2,0,0]=4 35 B19R3.10961 OCCN1CCn2cccc2C13CCCCC3 79497d481f8de44c6ec6c3d6d03fe1e3 [0,0,1,1,0,0|2,0,0]=4 36 B19R3.10961 SCCN1CCn2cccc2C13CCCCC3 9a616c7feb46ae023546271159071fd6 [0,0,1,1,0,0|2,0,0]=4 37 B19R3.1796121 c1csc(c1)C2(CCCCC2)CNCC3CC3 889e83314c989c6e7dc929b72dee8fb5 [0,0,1,1,0,0|2,0,0]=4 38 B17R2.8530 CCCNCC(c1ccco1)N2CCCC2 4794b05b4dd65fa684e24f2a7810882e [0,0,1,0,1,0|1,1,0]=4 39 B17R2.8530 CCCNCC(c1cccs1)N2CCCC2 a6cfd210768699b8104d43b011b90d8a [0,0,1,0,1,0|1,0,0]=3 40 B17R2.8530 COCNCC(c1cccs1)N2CCCC2 5e62d62164f192464c81a1750263b78c [0,0,1,0,1,0|2,0,0]=4 41 B17R2.8530 CSCNCC(c1cccs1)N2CCCC2 4a04704afa8f914c6b65e900a8555cf4 [0,0,1,0,1,0|2,0,0]=4 42 B17R2.8530 FCCNCC(c1cccs1)N2CCCC2 de9f0fa7a12f729930a8005bb478454f [0,0,1,0,1,0|2,0,0]=4 43 B17R2.8530 OCCNCC(c1cccs1)N2CCCC2 bc816955b3178f74fdcd4e0a35a9eebc [0,0,1,0,1,0|2,0,0]=4 44 B17R2.8530 SCCNCC(c1cccs1)N2CCCC2 bc543d8431d20dc64abd7149d0ed6c70 [0,0,1,0,1,0|2,0,0]=4 45 B21R3.2429829 c1csc(c1)C2(CCOCC2)COC3CCCCC3 352906f0b0b7cbe3e605607899c21552 [0,0,0,0,0,2|2,0,0]=4 46 B21R3.2430012 c1cc(sn1)NC2(CCCCC2)CN3CCOCC3 efb6d66f9e7fa3f712871fbe09bd8464 [0,0,0,0,0,2|2,0,0]=4 47 B21R3.2430012 c1coc(n1)NC2(CCCCC2)CN3CCCCC3 e323ed2b05c79bb09c3748758657eb6a [0,0,0,0,0,2|1,1,0]=4 48 B21R3.13902945 c1cc(co1)NCC2(CCCCC2)N3CCCCC3 8b1c07d9b797ca1eab410a78ff677eb6 [0,0,0,0,0,2|2,0,0]=4 49 B21R3.13902945 c1cc(sn1)NCC2(CCCCC2)N3CCCCC3 eaba45dfadc5cbf51223bd2ec31b3815 [0,0,0,0,0,2|1,0,0]=3 50 B21R3.13902945 c1cc(sn1)NCC2(CCCCC2)N3CCOCC3 424e9dbf13d5e072c6bbac3208a47fd1 [0,0,0,0,0,2|2,0,0]=4 51 B21R3.13902945 c1coc(c1)NCC2(CCCCC2)N3CCOCC3 1140dde1e720a3c6d1e02c9ef1283dbb [0,0,0,0,0,2|1,1,0]=4 52 B21R3.13902945 c1csc(c1)NCC2(CCCCC2)N3CCOCC3 accd1a5cec0298644ff26fc18ee174b8 [0,0,0,0,0,2|1,0,0]=3 53 B21R3.13902945 c1csc(n1)NCC2(CCCCC2)N3CCOCC3 6b1c1f794235f6c4f4ca3de9579299c6 [0,0,0,0,0,2|2,0,0]=4 54 B21R3.13902945 c1nc(c[nH]1)NCC2(CCCCC2)N3CCCCC3 4b9883a110e7feb14be3315c6932ceb3 [0,0,0,0,0,2|2,0,0]=4