0 B20R1.67918 C#CCCCCCCCC(=O)NCCc1sccc1C 4ae3acefd87de0ea1822d69d75904b61 [0,0,0,0,0,0|2,0,2]=4 1 B20R1.67918 C#CCCCCCCCC(=O)NCCc1scnc1C 716e1dbda16c8d392add4201b62fdc17 [0,0,0,0,0,0|1,0,2]=3 2 B20R1.67918 C#CCCCCCCNC(=O)NCCc1scnc1C f00f4829a15fbe44080326df37c44ddf [0,0,0,0,0,0|2,0,2]=4 3 B20R1.67918 C=CCCCCCCCC(=O)NCCc1sccc1C efcaaf0bf4185471fa761661aa5aafd0 [0,0,0,0,0,0|2,0,2]=4 4 B20R1.67918 C=CCCCCCCCC(=O)NCCc1scnc1C 78b4e53f8c5ddbee46edbe9473423a99 [0,0,0,0,0,0|1,0,2]=3 5 B20R1.67918 CCCCC/C=C/CCC(=O)NCCc1sccc1C 3a262adab4c5aa20482e2488df0eaa63 [0,0,0,0,0,0|2,0,2]=4 6 B20R1.67918 CCCCC/C=C/CCC(=O)NCCc1scnc1C 63b8698639c8e2681ff131f8ae52b035 [0,0,0,0,0,0|1,0,2]=3 7 B20R1.67918 CCCCCC/C=C/CC(=O)NCCc1sccc1C 4edebb83cfca3654146346a92eb3c168 [0,0,0,0,0,0|2,0,2]=4 8 B20R1.67918 CCCCCC/C=C/CC(=O)NCCc1scnc1C 378b66b0d0558a50a15fe7ad9e2093f8 [0,0,0,0,0,0|1,0,2]=3 9 B20R1.67918 CCCCCC=CCCC(=O)NCCc1sccc1C fffea8513068a9257397ca349ef6a606 [0,0,0,0,0,0|2,0,2]=4 10 B20R1.67918 CCCCCC=CCCC(=O)NCCc1scnc1C 1e98223da50f86fc2454eeb895e4d799 [0,0,0,0,0,0|1,0,2]=3 11 B20R1.67918 CCCCCCC/C=C/C(=O)NCCc1sccc1C 46d8f071f75fd4441c9bc360411645e7 [0,0,0,0,0,0|2,0,2]=4 12 B20R1.67918 CCCCCCC/C=C/C(=O)NCCc1scnc1C 4e127df6f0e146154d8f3bbfa1aa4b80 [0,0,0,0,0,0|1,0,2]=3 13 B20R1.67918 CCCCCCC/C=C\C(=O)NCCc1sccc1C d11626cc383c6c84f534020c906b780e [0,0,0,0,0,0|2,0,2]=4 14 B20R1.67918 CCCCCCC/C=C\C(=O)NCCc1scnc1C 170c6320bb21742bfc3373db8a79dfc0 [0,0,0,0,0,0|1,0,2]=3 15 B20R1.67918 CCCCCCC=CCC(=O)NCCc1sccc1C 623d5bdb123fbe0da0cb7c6b4d1a4084 [0,0,0,0,0,0|2,0,2]=4 16 B20R1.67918 CCCCCCC=CCC(=O)NCCc1scnc1C a7151d9bdd1158c25ec12ba3e01e20dd [0,0,0,0,0,0|1,0,2]=3 17 B20R1.67918 CCCCCCCC=CC(=O)NCCc1sccc1C 32f5412f6327ae414fcb2a54bd262695 [0,0,0,0,0,0|2,0,2]=4 18 B20R1.67918 CCCCCCCC=CC(=O)NCCc1scnc1C 569dd6b665045c49bfee14745168226e [0,0,0,0,0,0|1,0,2]=3 19 B20R1.67918 CCCCCCCCCC(=O)NCCc1cccn1C c37bf08dea9f4278b733c991073b58b7 [0,0,0,0,0,0|4,0,0]=4 20 B20R1.67918 CCCCCCCCCC(=O)NCCc1ccnn1C bcfc9ac86434fed61c41add800088fa1 [0,0,0,0,0,0|3,0,0]=3 21 B20R1.67918 CCCCCCCCCC(=O)NCCc1ccsc1Br d14e6b6f376d6b51b0692958858bb186 [0,0,0,0,0,0|4,0,0]=4 22 B20R1.67918 CCCCCCCCCC(=O)NCCc1nccn1C 164e0cbebf1522a69c02e8f4ed3a63e8 [0,0,0,0,0,0|4,0,0]=4 23 B20R1.67918 CCCCCCCCCC(=O)NCCc1sccc1C 6170dc7c768a9cb655a2b54db8318ec3 [0,0,0,0,0,0|2,0,0]=2 24 B20R1.67918 CCCCCCCCCC(=O)NCCc1scnc1C 00ab49f595aacf49aedaa2c596be998e [0,0,0,0,0,0|1,0,0]=1 25 B20R1.67918 CCCCCCCCCC(=O)OCNc1c[nH]nc1C ce72a9c644e3e526087dc96f03816b3a [0,0,0,0,0,0|3,0,0]=3 26 B20R1.67918 CCCCCCCCCC(=O)OCOc1cccn1C b7ab7c6340cfcf1c7dc3d01085a0fdaa [0,0,0,0,0,0|4,0,0]=4 27 B20R1.67918 CCCCCCCCCC(=O)OCOc1ccnn1C de821ab3020826810d2007a3e5f74e4d [0,0,0,0,0,0|3,0,0]=3 28 B20R1.67918 CCCCCCCCCC(=O)OCOc1cn[nH]c1C a57cc0544cb6ebf3bb9692c246a5ac9f [0,0,0,0,0,0|3,0,1]=4 29 B20R1.67918 CCCCCCCCCC(=O)OCOc1n[nH]cc1C 1cffb1c3eed532a91cc4caa63dfccdae [0,0,0,0,0,0|4,0,0]=4 30 B20R1.67918 CCCCCCCCCC(=O)OCOc1nsnc1Cl 9176e93092807a72138831dd31e7e953 [0,0,0,0,0,0|4,0,0]=4 31 B20R1.67918 CCCCCCCCCC(C)COCc1scnc1C f74c19e7134513fcd058c339d2ff899e [0,0,0,0,0,0|3,0,1]=4 32 B20R1.67918 CCCCCCCCCC(C)OCCc1scnc1C 2f256505c7f08a7563e41ae9286269d5 [0,0,0,0,0,0|1,0,1]=2 33 B20R1.67918 CCCCCCCCC[C@@H](C)OCCc1scnc1C b625d1a47478113311b24ba6fbf44118 [0,0,0,0,0,0|1,0,1]=2 34 B20R1.67918 CCCCCCCCNC(=O)NCCc1ccnn1C 1da8a5e40245065e10f750581524db9d [0,0,0,0,0,0|4,0,0]=4 35 B20R1.67918 CCCCCCCCNC(=S)NCCc1sccc1C ca4aca4b027ecc1b1a0f3a9dda9eca06 [0,0,0,0,0,0|3,1,0]=4 36 B20R1.67918 CCCCCCCCNC(=S)NCCc1scnc1C 75726bc10d17598158a8f5faf3014353 [0,0,0,0,0,0|2,1,0]=3 37 B20R1.67918 CCCCOCCCNC(=O)NCCc1sccc1C 2f7fa9fcbb56bdf8a2efcce8bdc67210 [0,0,0,0,0,0|4,0,0]=4 38 B20R1.67918 CCCCOCCCNC(=O)NCCc1scnc1C afe505179fb6d217f135e232ba27d404 [0,0,0,0,0,0|3,0,0]=3 39 B20R1.67918 CCCCOCCCNC(=S)NCCc1scnc1C 117216677c407e74b4fc0fecf91f72d3 [0,0,0,0,0,0|3,1,0]=4 40 B20R1.67918 CCCCOCCOCC(=O)NCCc1sccc1C 958191b21208ca58ae55766b32cd6792 [0,0,0,0,0,0|4,0,0]=4 41 B20R1.67918 CCCCOCCOCC(=O)NCCc1scnc1C f80aa2f71bba1864182010e726d0fb81 [0,0,0,0,0,0|3,0,0]=3 42 B20R1.67918 CCCSCCCCNC(=O)NCCc1sccc1C 32b0466247958ea5ba6c2424b7c6ad9e [0,0,0,0,0,0|4,0,0]=4 43 B20R1.67918 CCCSCCCCNC(=O)NCCc1scnc1C 5ddfcc2797166d2ef009fb4d649cb949 [0,0,0,0,0,0|3,0,0]=3 44 B20R1.67918 CCCSCCCCNC(=S)NCCc1scnc1C 98230d79adc664c42ecdc6fdf4c06b57 [0,0,0,0,0,0|3,1,0]=4 45 B20R1.67918 COCCOCCCNC(=O)NCCc1scnc1C d741e0576f5011fda5bc382c0213adaa [0,0,0,0,0,0|4,0,0]=4 46 B20R1.67918 COCCOCCOCC(=O)NCCc1scnc1C f898af63b7a2e300b6d050622ba87f34 [0,0,0,0,0,0|4,0,0]=4 47 B20R1.67918 CSCCOCCCNC(=O)NCCc1scnc1C ef47a433210bd339cbd1ef41103f2a69 [0,0,0,0,0,0|4,0,0]=4 48 B20R1.67918 Cc1ccsc1CCNC(=O)CCCCCCCC=O da3a04182c2530b7e822fb44b8926dc2 [0,0,0,0,0,0|3,0,1]=4 49 B20R1.67918 Cc1ccsc1CCNC(=O)CCCCCCCCO 3b985a6f4c2d6dad950e678a5ea5e124 [0,0,0,0,0,0|3,0,0]=3 50 B20R1.67918 Cc1ccsc1CCNC(=O)CCCCCCCCS d8bc0bf43cd5647aa9fc5c70af11637c [0,0,0,0,0,0|3,0,0]=3 51 B20R1.67918 Cc1ccsc1CCNC(=O)NCCCCCCCN c5df001cd82eebc7f644c1e7125bf424 [0,0,0,0,0,0|4,0,0]=4 52 B20R1.67918 Cc1ccsc1CCNC(=O)NCCCCCCCO 74e16291287166821caf3cca73fb7676 [0,0,0,0,0,0|4,0,0]=4 53 B20R1.67918 Cc1ncsc1CCNC(=O)CCCCCCCC=O edbf60b7a598b5ee6511ef85044a54d3 [0,0,0,0,0,0|2,0,1]=3 54 B20R1.67918 Cc1ncsc1CCNC(=O)CCCCCCCCO 1bcc414ad3f3873872b476317d7f4c6b [0,0,0,0,0,0|2,0,0]=2 55 B20R1.67918 Cc1ncsc1CCNC(=O)CCCCCCCCS 2852ffdae3e2187273bf2a2df65a1e28 [0,0,0,0,0,0|2,0,0]=2 56 B20R1.67918 Cc1ncsc1CCNC(=O)CCOCCOCCO 05a6c450136342f5e2d2201aa93af7fc [0,0,0,0,0,0|4,0,0]=4 57 B20R1.67918 Cc1ncsc1CCNC(=O)CCOCCOCCS 0e50ec3eef7fb89026da66e9ccf8f8f4 [0,0,0,0,0,0|4,0,0]=4 58 B20R1.67918 Cc1ncsc1CCNC(=O)NCCCCCCCN 0a99f1e952cfdbf890582730c35e74a5 [0,0,0,0,0,0|3,0,0]=3 59 B20R1.67918 Cc1ncsc1CCNC(=O)NCCCCCCCO 7953a47b2d8acf12f1f759aa755d42a2 [0,0,0,0,0,0|3,0,0]=3 60 B20R1.67918 Cc1ncsc1CCNC(=O)NCCCCSCCO 3ee8debcfd15de95ebf4aca3d02606fa [0,0,0,0,0,0|4,0,0]=4 61 B20R1.67918 Cc1ncsc1CCNC(=O)NCCCOCCCN 51c704993f91d0f20a4ec905038f920d [0,0,0,0,0,0|4,0,0]=4 62 B20R1.67918 Cc1ncsc1CCNC(=O)NCCCOCCCO 8ad4a2c5f38b96f3e384187e5085d99f [0,0,0,0,0,0|4,0,0]=4 63 B20R1.67918 Cc1ncsc1CCNC(=S)NCCCCCCCN f5d75893f5bd81745c908b379bc4b91c [0,0,0,0,0,0|3,1,0]=4 64 B20R1.67918 Cc1ncsc1CCNC(=S)NCCCCCCCO 279425e0dea1ff0e724a89aac4b0ad09 [0,0,0,0,0,0|3,1,0]=4 65 B20R1.67918 Cn1nccc1CCNC(=O)CCCCCCCCO dd975ecd4804ed14fc21726cad3f5b05 [0,0,0,0,0,0|4,0,0]=4 66 B20R1.67918 Cn1nccc1CCNC(=O)CCCCCCCCS 748cf2ed63eba97db8470227bcdda2c7 [0,0,0,0,0,0|4,0,0]=4 67 B19R1.46476 CCCCCCCCCC(=O)NCCc1ccco1 e8c5acd2881cb70ae25020b79402e445 [1,0,0,0,0,0|2,1,0]=4 68 B19R1.46476 CCCCCCCCCC(=O)NCCc1cccs1 0079a94710ffb393e661d9d0d6267f83 [1,0,0,0,0,0|2,0,0]=3 69 B19R1.46476 CCCCCCCCCC(=O)NCCc1ccsc1 c3688e3599f7e29f65ba5e775b0cb0e8 [1,0,0,0,0,0|3,0,0]=4 70 B19R1.46476 CCCCCCCCCC(=O)NCCc1cnoc1 bb7dff6ac2b9a40af263a585b1de2378 [1,0,0,0,0,0|3,0,0]=4 71 B19R1.46476 CCCCCCCCCC(=O)NCCc1cscn1 e3852638b9a30553b469c765af69a2a6 [1,0,0,0,0,0|3,0,0]=4 72 B19R1.46476 CCCCCCCCCC(=O)NCCc1nccs1 28ffdc597544f6d5d4792253f20ce0cd [1,0,0,0,0,0|3,0,0]=4 73 B19R1.46476 CCCCCCCCCC(=O)NCCc1nncs1 52af75932fea2b529f1ecd2d1aef9b26 [1,0,0,0,0,0|2,0,0]=3 74 B19R1.46476 CCCCCCCCCC(=O)NCCn1ccnc1 d0c402042a54e845657623df3070e037 [1,0,0,0,0,0|3,0,0]=4 75 B19R1.46476 CCCCCCCCCC(=O)NCCn1cncn1 d858b0e018f80e35be0ce9eabafe8e5e [1,0,0,0,0,0|3,0,0]=4 76 B19R1.46476 CCCCCCCCCC(=O)OCNc1ccsc1 66fec4a5540bb30e53f1aeb87136951e [1,0,0,0,0,0|3,0,0]=4 77 B19R1.46476 CCCCCCCCCC(=O)OCOc1c[nH]cn1 3a2b052f6bb03a9080e14ec313a659bd [1,0,0,0,0,0|2,0,1]=4 78 B19R1.46476 CCCCCCCCCC(=O)OCOc1ccco1 ea7a295380407130e3a7ec85f25bc4c3 [1,0,0,0,0,0|2,1,0]=4 79 B19R1.46476 CCCCCCCCCC(=O)OCOc1ccn[nH]1 e809b4d975f590c3d3406bd116423795 [1,0,0,0,0,0|3,0,0]=4 80 B19R1.46476 CCCCCCCCCC(=O)OCOc1cn[nH]c1 69c58ed38ac108cf5885c497debeb980 [1,0,0,0,0,0|3,0,0]=4 81 B19R1.46476 CCCCCCCCCC(=O)OCOc1cnoc1 1dcba9623d67bccd3a14993d06559a64 [1,0,0,0,0,0|3,0,0]=4 82 B19R1.46476 CCCCCCCCCC(=O)OCOn1ccnc1 93b1f3cb3557934d83711e98d94c623f [1,0,0,0,0,0|3,0,0]=4 83 B19R1.46476 CCCCCCCCCC(C)OCCc1cccs1 d01eac79aa0c2647e2137acf2e991f35 [1,0,0,0,0,0|2,0,1]=4 84 B19R1.46476 CCCCCCCCC[C@@H](C)OCCc1cccs1 6405f54d568096e34278df0670fc6cf1 [1,0,0,0,0,0|2,0,1]=4 85 B19R1.46476 CCCCCCCCNC(=O)CCCc1cccs1 2770ebce3a8bfe57500ae21e0b2f35f9 [1,0,0,0,0,0|3,0,0]=4 86 B19R1.46476 CCCCCCCCNC(=O)NCCc1nncs1 4156bf80acae3055144f01ed796c9a0b [1,0,0,0,0,0|3,0,0]=4 87 B19R1.46476 CCCCCCCNCC(=O)NCCc1cccs1 77d9231c8503bff5d80afce7ef2e2abf [1,0,0,0,0,0|3,0,0]=4 88 B19R1.46476 CCCCCCCOCC(=O)NCCc1cccs1 b23d21a0905bf879d40b8b2ac2417361 [1,0,0,0,0,0|3,0,0]=4 89 B19R1.46476 CCCCCCNCCC(=O)NCCc1cnc[nH]1 06a34ffdccfb717c1bc570eb72a6054d [1,0,0,0,0,0|3,0,0]=4 90 B19R1.46476 O=C(CCCCCCCCO)NCCc1cccs1 0b9c6392c5a0b4d82de43d5cbe0c902f [1,0,0,0,0,0|3,0,0]=4 91 B19R1.46476 O=C(CCCCCCCCO)NCCc1nncs1 0b007e9581daae5b1ce31eae51e85eb6 [1,0,0,0,0,0|3,0,0]=4 92 B19R1.46476 O=C(CCCCCCCCS)NCCc1cccs1 21a0946342f4040d1b84663b1dd064dd [1,0,0,0,0,0|3,0,0]=4 93 B19R1.46476 O=C(CCCCCCCCS)NCCc1nncs1 8c8e0095302a31d31ede0439ba046b88 [1,0,0,0,0,0|3,0,0]=4 94 B19R1.46518 C#CCCCCCCCCOCCc1scnc1C c0a6b8a31be67bc0972e376760434501 [1,0,0,0,0,0|0,0,3]=4 95 B19R1.46518 C=CCCCCCCCCOCCc1scnc1C 716a03e668497757f7cd0ec783a87271 [1,0,0,0,0,0|0,0,3]=4 96 B19R1.46518 CCCC/C=C/CCCCOCCc1scnc1C 07302b2cf44edd2189622adedcb3742a [1,0,0,0,0,0|0,0,3]=4 97 B19R1.46518 CCCC/C=C\CCCCOCCc1scnc1C e4ef725a7972a8a1012c5d1c41340536 [1,0,0,0,0,0|0,0,3]=4 98 B19R1.46518 CCCCC#CCCCCOCCc1scnc1C 4127b95262bc9735cfb7b5f273f6d623 [1,0,0,0,0,0|0,0,3]=4 99 B19R1.46518 CCCCC/C=C\CCCOCCc1scnc1C 5abaf60385746ef27d7cb6c9a22d7554 [1,0,0,0,0,0|0,0,3]=4 100 B19R1.46518 CCCCCC=CCCCOCCc1scnc1C 6d2a976ce69cff19604e09392260e240 [1,0,0,0,0,0|0,0,3]=4 101 B19R1.46518 CCCCCCC#CCCOCCc1scnc1C 247f349965ffcb71396ac90a49d85846 [1,0,0,0,0,0|0,0,3]=4 102 B19R1.46518 CCCCCCCC#CCOCCc1scnc1C ff00e24c243c031976a70b9e5e0485ef [1,0,0,0,0,0|0,0,3]=4 103 B19R1.46518 CCCCCCCC/C=C/COCc1scnc1C 6cd33d71712086b8b1b27672f1b78c2c [1,0,0,0,0,0|2,0,1]=4 104 B19R1.46518 CCCCCCCCCCCCNc1scnc1C 19e55c9377270d19fd2f00f741fc6435 [1,0,0,0,0,0|2,0,1]=4 105 B19R1.46518 CCCCCCCCCCCNCc1scnc1C 854faf9a7b0cff5e3b3872eef2ff603e [1,0,0,0,0,0|2,0,1]=4 106 B19R1.46518 CCCCCCCCCCCOCc1scnc1C a93bce30f1a2edcbcdf9f9ef86ec02dc [1,0,0,0,0,0|2,0,1]=4 107 B19R1.46518 CCCCCCCCCCNCCc1sccc1C 0b462126778ca4556d144ddf66a932ff [1,0,0,0,0,0|2,0,1]=4 108 B19R1.46518 CCCCCCCCCCNCCc1scnc1C 9947a18e0b568b11fe8d2ac177da9959 [1,0,0,0,0,0|1,0,1]=3 109 B19R1.46518 CCCCCCCCCCOCCc1ncsc1C 162a7a21975c1e92daec4bc9ed750cb7 [1,0,0,0,0,0|2,0,1]=4 110 B19R1.46518 CCCCCCCCCCOCCc1scnc1C dbfb6330badfda8d0568d8b6bf77eeb7 [1,0,0,0,0,0|0,0,1]=2 111 B19R1.46518 CCCCCCCCCCOCCn1ccnc1C e1dda3d319c1fd7db0975c6bc7f928c2 [1,0,0,0,0,0|2,0,1]=4 112 B19R1.46518 CCCCCCCCCNCCCc1scnc1C 4095918e0bc71d3287db84486a55b5b9 [1,0,0,0,0,0|2,0,0]=3 113 B19R1.46518 CCCCCCCCCOCCCc1scnc1C 81c4a3c6411dae8ce40bf080164b5422 [1,0,0,0,0,0|2,0,0]=3 114 B19R1.46518 CCCCCCCCOCOCCc1scnc1C f59fd4b0a0e8edf6016934d5e95f313b [1,0,0,0,0,0|1,0,1]=3 115 B19R1.46518 CCCCOCCOCCOCCc1scnc1C 14adbf36533048b233c12a513f0abc1b [1,0,0,0,0,0|2,0,1]=4 116 B19R1.46518 Cc1ncsc1CCCNCCCCCCCCO 837ec19713e7de602100208d4428a101 [1,0,0,0,0,0|3,0,0]=4 117 B19R1.46518 Cc1ncsc1CCNCCCCCCCCCO 71e1e7f3f3812d9a6d72a5250f1c92cf [1,0,0,0,0,0|2,0,1]=4 118 B19R1.46518 Cc1ncsc1CCOCCCCCCCCC=O 862add78fe1ede3b77ecf684a5aab72d [1,0,0,0,0,0|1,0,2]=4 119 B19R1.46518 Cc1ncsc1CCOCCCCCCCCCS 200f318e306d811cf28db68c03d623be [1,0,0,0,0,0|1,0,1]=3 120 B19R1.48340 C#CCCCCCCC(=O)NCCc1scnc1C ca33e04561718c3028042dc16168ff91 [1,0,0,0,0,0|1,0,2]=4 121 B19R1.48340 C=CCCCCCCC(=O)NCCc1scnc1C bbe841401b402a5b84a470b2f651d1c9 [1,0,0,0,0,0|1,0,2]=4 122 B19R1.48340 CCC/C=C/CCCC(=O)NCCc1scnc1C a929a850de88c87c8975c1f803543694 [1,0,0,0,0,0|1,0,2]=4 123 B19R1.48340 CCCCC/C=C/CC(=O)NCCc1scnc1C 2a9fa7ababaebff0a220cae7c75ed78c [1,0,0,0,0,0|1,0,2]=4 124 B19R1.48340 CCCCC=CCCC(=O)NCCc1scnc1C 334f29ab2f59f3e1ecac276e3f3f5225 [1,0,0,0,0,0|1,0,2]=4 125 B19R1.48340 CCCCCC/C=C/C(=O)NCCc1scnc1C 25892ea113865d1893abd647d218a689 [1,0,0,0,0,0|1,0,2]=4 126 B19R1.48340 CCCCCCCCC(=O)NCCc1ccnn1C ce88bc1d7330c416663617d14a7be2ab [1,0,0,0,0,0|3,0,0]=4 127 B19R1.48340 CCCCCCCCC(=O)NCCc1sccc1C 7aaead3ba953f298671c87b955c06efa [1,0,0,0,0,0|2,0,0]=3 128 B19R1.48340 CCCCCCCCC(=O)NCCc1scnc1C 50a456c92a3cfebf3ea31850a5b8d7ee [1,0,0,0,0,0|1,0,0]=2 129 B19R1.48340 CCCCCCCCC(=O)OCNc1c[nH]nc1C 2ebe63f2e6c4fb190b41ad3a2d78c5ba [1,0,0,0,0,0|3,0,0]=4 130 B19R1.48340 CCCCCCCCC(=O)OCOc1ccnn1C 2b6a231747f2e30fded7b12687b62b27 [1,0,0,0,0,0|3,0,0]=4 131 B19R1.48340 CCCCCCCCC(C)NCCc1scnc1C 635091b9087bb6dc1ffc4cf803ad9dbf [1,0,0,0,0,0|2,0,1]=4 132 B19R1.48340 CCCCCCCCC(C)OCCc1scnc1C 19867c799c2f12caa3193827ea6717f8 [1,0,0,0,0,0|1,0,1]=3 133 B19R1.48340 CCCCCCCC[C@@H](C)OCCc1scnc1C 6a9a782b38c270db9a97e24273bb6748 [1,0,0,0,0,0|1,0,1]=3 134 B19R1.48340 CCCCCCCNC(=S)NCCc1scnc1C ef2b4cb615637c6cb1a133e783b6b4ed [1,0,0,0,0,0|2,1,0]=4 135 B19R1.48340 CCCOCCCNC(=O)NCCc1scnc1C 904bd431119e911924f3b34cb4f7533a [1,0,0,0,0,0|3,0,0]=4 136 B19R1.48340 CCOCCOCCC(=O)NCCc1scnc1C 36e7b014c94a244ebf356ac6760983b4 [1,0,0,0,0,0|3,0,0]=4 137 B19R1.48340 CCSCCCCNC(=O)NCCc1scnc1C a9615e913b727dec08e60a3fab4f2152 [1,0,0,0,0,0|3,0,0]=4 138 B19R1.48340 COCCCCCNC(=O)NCCc1scnc1C 918c2f8c7c86732514aa7632e5c20deb [1,0,0,0,0,0|3,0,0]=4 139 B19R1.48340 CSCCCCCCC(=O)NCCc1sccc1C ddfce7437bab39c3ec6fb9bca2541012 [1,0,0,0,0,0|3,0,0]=4 140 B19R1.48340 CSCCCCCCC(=O)NCCc1scnc1C 89493d9f0efb5e53ccec724e2cbac5c2 [1,0,0,0,0,0|2,0,0]=3 141 B19R1.48340 Cc1ccsc1CCNC(=O)CCCCCCCF 52574da6445374c525420741178c7909 [1,0,0,0,0,0|3,0,0]=4 142 B19R1.48340 Cc1ccsc1CCNC(=O)CCCCCCCO e68a4d9385f9a367c38852875f5aad67 [1,0,0,0,0,0|3,0,0]=4 143 B19R1.48340 Cc1ccsc1CCNC(=O)CCCCCCCS 4dc8889e7ae87a9afe8972715751b983 [1,0,0,0,0,0|3,0,0]=4 144 B19R1.48340 Cc1ncsc1CCNC(=O)CCCCCCC=O 2c3ae39042c8d5cac367c8e2a2f31a6a [1,0,0,0,0,0|2,0,1]=4 145 B19R1.48340 Cc1ncsc1CCNC(=O)CCCCCCCF e42463ec76f0bb972e978c5a297d8502 [1,0,0,0,0,0|2,0,0]=3 146 B19R1.48340 Cc1ncsc1CCNC(=O)CCCCCCCO ab8d2de85ed81c6a2fc49207d287d591 [1,0,0,0,0,0|2,0,0]=3 147 B19R1.48340 Cc1ncsc1CCNC(=O)CCCCCCCS 6cb75e57fb25d29a6f426a9d1f84e637 [1,0,0,0,0,0|2,0,0]=3 148 B19R1.48340 Cc1ncsc1CCNC(=O)CCCCOCCO aef00da44a24627dee1fea57a4e8d8f2 [1,0,0,0,0,0|3,0,0]=4 149 B19R1.48340 Cc1ncsc1CCNC(=O)NCCCCCCN 74c6d857163f0f61883ab75381ec0e8f [1,0,0,0,0,0|3,0,0]=4 150 B19R1.48340 Cc1ncsc1CCNC(=O)NCCCCCCO 9d933e8ccc89e5e987a078c043e8e0c9 [1,0,0,0,0,0|3,0,0]=4 151 B21R1.8362 CC(=O)CCCCCCCC(=O)NCCc1sccc1C 7e4ea42ffeda43ee714041355456a4f3 [0,1,0,0,0,0|2,0,1]=4 152 B21R1.8362 CC(=O)CCCCCCCC(=O)NCCc1scnc1C 15fc450c78c1f0b5b10fe7eeafb36e52 [0,1,0,0,0,0|1,0,1]=3 153 B21R1.8362 Cc1ccsc1CCNC(=O)NCCCCCCC(C)C a0353e5bcd1ebab3ec7cafa40097548d [0,1,0,0,0,0|3,0,0]=4 154 B21R1.8362 Cc1ncsc1CCNC(=O)CCCCCCCC(=O)N 777d88cfd93aa4ddd306515792d22559 [0,1,0,0,0,0|2,0,1]=4 155 B21R1.8362 Cc1ncsc1CCNC(=O)NCCCCCCC(C)C 73948e1626b513fd51be4aa9b9175712 [0,1,0,0,0,0|2,0,0]=3 156 B21R1.8362 Cc1ncsc1CCNC(=O)NCCCCCCN(C)C a4269416db61cb2616c722e7debf62bf [0,1,0,0,0,0|3,0,0]=4 157 B21R1.8362 Cc1ncsc1CCNC(=O)NCCCCSCC(C)C 221954c6573f40c4961c0255ac72308b [0,1,0,0,0,0|3,0,0]=4 158 B21R1.8362 Cc1ncsc1CCNC(=S)NCCCCCCC(C)C eca17ee13c17fd7ddbc9607b0d4c5731 [0,1,0,0,0,0|2,1,0]=4 159 B21R1.18594 CCCCCCCCCC(=O)NC(C)Cc1ccnn1C 09681cab00661a10173271ff8311a198 [0,1,0,0,0,0|3,0,0]=4 160 B21R1.19507 CCCCCCCCCC(=O)NCCc1ccnn1CC ccf43a761958fc95922467605196b8d5 [0,1,0,0,0,0|3,0,0]=4 161 B21R1.19507 CCCCCCCCCC(=O)NCCn1ccnc1CC 1bf84818f77845e4b98f960d21163db6 [0,1,0,0,0,0|3,0,0]=4 162 B21R1.19507 CCCCCCCCCC(=O)OCOc1ccnn1CC 1d59068761b400a91036d1457d4dcc60 [0,1,0,0,0,0|3,0,0]=4 163 B21R1.19788 C#CCCCCCCCCC(=O)NCCc1sccc1C 4cd569fec290c9fe137f00731111decb [0,1,0,0,0,0|2,0,1]=4 164 B21R1.19788 C#CCCCCCCCCC(=O)NCCc1scnc1C 8f9802c460ab2547a17d68bf2aee4070 [0,1,0,0,0,0|1,0,1]=3 165 B21R1.19788 C=CCCCCCCCCC(=O)NCCc1sccc1C 10533f895b51d29ddc3be3fa54a1c341 [0,1,0,0,0,0|2,0,1]=4 166 B21R1.19788 C=CCCCCCCCCC(=O)NCCc1scnc1C 23bafef8f33ef79c121e1a26cf2b6e25 [0,1,0,0,0,0|1,0,1]=3 167 B21R1.19788 CCCCCCCC/C=C/C(=O)NCCc1sccc1C 56886614dcb5999539e5892a8912e574 [0,1,0,0,0,0|2,0,1]=4 168 B21R1.19788 CCCCCCCC/C=C/C(=O)NCCc1scnc1C c20408a88b390b72ed0773ed738aa052 [0,1,0,0,0,0|1,0,1]=3 169 B21R1.19788 CCCCCCCCC=CC(=O)NCCc1sccc1C d85bb56c97264a51978246a0686b92cf [0,1,0,0,0,0|2,0,1]=4 170 B21R1.19788 CCCCCCCCC=CC(=O)NCCc1scnc1C ce1da49d2142dad63c690a20afddd4df [0,1,0,0,0,0|1,0,1]=3 171 B21R1.19788 CCCCCCCCCCC(=O)NCCc1ccnn1C 95ed6c8445b3d7c6b958ce6e0d5f930a [0,1,0,0,0,0|3,0,0]=4 172 B21R1.19788 CCCCCCCCCCC(=O)NCCc1sccc1C 563d2a1a29286336177288af9a65221c [0,1,0,0,0,0|2,0,0]=3 173 B21R1.19788 CCCCCCCCCCC(=O)NCCc1scnc1C 5ecd665e44a6dce47999103c0101ec10 [0,1,0,0,0,0|1,0,0]=2 174 B21R1.19788 CCCCCCCCCCC(C)OCCc1scnc1C bc18697b265bbb2f6548881be0b329c9 [0,1,0,0,0,0|1,0,1]=3 175 B21R1.19788 CCCCCCCCCC[C@H](C)OCCc1scnc1C 67d4d6474420c75723d01aecada41f33 [0,1,0,0,0,0|1,0,1]=3 176 B21R1.19788 CCCCCCCCCNC(=O)NCCc1ccnn1C ee01f0992b91f2ab8bb23a42ee01f559 [0,1,0,0,0,0|3,0,0]=4 177 B21R1.19788 CCCCCCCCCNC(=S)NCCc1sccc1C 189136e447c96388e01b6a69320f1117 [0,1,0,0,0,0|2,1,0]=4 178 B21R1.19788 CCCCCCCCCNC(=S)NCCc1scnc1C 53789f50eac052650e51543b5c70a101 [0,1,0,0,0,0|1,1,0]=3 179 B21R1.19788 CCCCCCCCOCC(=O)NCCc1ccnn1C 00b31b2fc68f439ad1183bbb5d5fd692 [0,1,0,0,0,0|3,0,0]=4 180 B21R1.19788 CCCCCCCCOCC(=O)NCCc1sccc1C c3180b3e08b0e6fb2c97612dc562c9d0 [0,1,0,0,0,0|2,0,0]=3 181 B21R1.19788 CCCCCCCCOCC(=O)NCCc1scnc1C 9f3a6cfe1cd74fb0575965d8a566fc21 [0,1,0,0,0,0|1,0,0]=2 182 B21R1.19788 COCCOCCCCCC(=O)NCCc1sccc1C e8e17f8000c2fd72720756229591d505 [0,1,0,0,0,0|3,0,0]=4 183 B21R1.19788 COCCOCCCCCC(=O)NCCc1scnc1C 18033ca8bc0b43d47e21b41ad5e62c5b [0,1,0,0,0,0|2,0,0]=3 184 B21R1.19788 COCCOCCCCNC(=O)NCCc1scnc1C 8c0cacc0da0faa6cecbba9311221fc5d [0,1,0,0,0,0|3,0,0]=4 185 B21R1.19788 COCCOCCOCCC(=O)NCCc1scnc1C d5ad8737b224e3b73517ca9ecfc906b8 [0,1,0,0,0,0|3,0,0]=4 186 B21R1.19788 Cc1ccsc1CCNC(=O)CCCCCCCCC=O f921ddd8f925fe42f2fd5323d2891c0f [0,1,0,0,0,0|2,0,1]=4 187 B21R1.19788 Cc1ccsc1CCNC(=O)CCCCCCCCCF 38e4e1c32741905f017ecc748ef74deb [0,1,0,0,0,0|2,0,0]=3 188 B21R1.19788 Cc1ccsc1CCNC(=O)CCCCCCCCCO 12b6f0cf21f04ccf6a975c57c071ca86 [0,1,0,0,0,0|2,0,0]=3 189 B21R1.19788 Cc1ccsc1CCNC(=O)NCCCCCCCCN c856d1dde6795d2dd82426fb2d14b2e5 [0,1,0,0,0,0|3,0,0]=4 190 B21R1.19788 Cc1ccsc1CCNC(=O)NCCCCCCCCO a6e998ff60cffe5394f4ac6d2bd573fe [0,1,0,0,0,0|3,0,0]=4 191 B21R1.19788 Cc1ncsc1CCNC(=O)/C=C/CCCCCCCO 3c8ab0f039471cbb2ed017c8918e5318 [0,1,0,0,0,0|1,0,2]=4 192 B21R1.19788 Cc1ncsc1CCNC(=O)C=CCCCCCCCO 443df6fdc9c6c72dd42259b93df81252 [0,1,0,0,0,0|1,0,2]=4 193 B21R1.19788 Cc1ncsc1CCNC(=O)CCCCCCCCC=O d4aa884f5a674e7d22331948d7f6719e [0,1,0,0,0,0|1,0,1]=3 194 B21R1.19788 Cc1ncsc1CCNC(=O)CCCCCCCCCF f9ceb2e04967e50a24995990b04bab86 [0,1,0,0,0,0|1,0,0]=2 195 B21R1.19788 Cc1ncsc1CCNC(=O)CCCCCCCCCO 515ab9514c9db89f1d18fac833601c96 [0,1,0,0,0,0|1,0,0]=2 196 B21R1.19788 Cc1ncsc1CCNC(=O)NCCCCCCCCN 58f2b797add935f3ed4ced7b05f41bbd [0,1,0,0,0,0|2,0,0]=3 197 B21R1.19788 Cc1ncsc1CCNC(=O)NCCCCCCCCO d3cbaf6eea9a8eecbf5ff053b978af60 [0,1,0,0,0,0|2,0,0]=3 198 B21R1.19788 Cc1ncsc1CCNC(=S)NCCCCCCCCN 026faae2fb03d80487c46f1647716294 [0,1,0,0,0,0|2,1,0]=4 199 B21R1.19788 Cc1ncsc1CCNC(=S)NCCCCCCCCO 41dc9ff7f669ac6d204cb45367cc81b1 [0,1,0,0,0,0|2,1,0]=4 200 B21R1.19788 Cn1nccc1CCNC(=O)CCCCCCCCCF d4e0dce024cc902d71e31410c0f58508 [0,1,0,0,0,0|3,0,0]=4 201 B21R1.19788 Cn1nccc1CCNC(=O)CCCCCCCCCO 80e28145a847c5e637f0cb3a875c712c [0,1,0,0,0,0|3,0,0]=4 202 B21R1.20228 CCCCCCCCCN(C)C(=O)CCc1scnc1C 0955243b32b90f02af7056b7c7f96288 [0,1,0,0,0,0|3,0,0]=4 203 B21R1.20228 CCCCCCCCNC(=O)C(=O)NCc1scnc1C 58ce2d5fae63582dc78a476d02bae9c3 [0,1,0,0,0,0|3,0,0]=4 204 B21R1.73518 CCC(C)CCCCCCC(=O)NCCc1ccnn1C 31a1cc548647dc454236fc7ee424fc50 [0,1,0,0,0,0|3,0,0]=4 205 B21R1.73518 CCC(C)CCCCCCC(=O)NCCc1sccc1C 750b6638b55e01612f59e6f5b067817b [0,1,0,0,0,0|2,0,0]=3 206 B21R1.73518 CCC(C)CCCCCCC(=O)NCCc1scnc1C b2f0f33c9a98fe3450861a5fdf1ec078 [0,1,0,0,0,0|1,0,0]=2 207 B21R1.73518 COC(=O)CCCCCCC(=O)NCCc1scnc1C 0ae1a8f0f1ed9a6729edd375669534b8 [0,1,0,0,0,0|2,0,1]=4 208 B21R1.82587 CCCCC(=O)CCCCC(=O)NCCc1sccc1C b91644a986079d48681e5867ac6ff0bc [0,1,0,0,0,0|2,0,1]=4 209 B21R1.82587 CCCCC(=O)CCCCC(=O)NCCc1scnc1C c5f9e172ac37ce2c90436e95919135f2 [0,1,0,0,0,0|1,0,1]=3 210 B21R1.82587 CCCCN(C)CCCNC(=O)NCCc1scnc1C 1408cd9277071201d0bc4808de2ba73f [0,1,0,0,0,0|3,0,0]=4 211 B21R1.86024 CCOC(=O)CCCCCC(=O)NCCc1scnc1C a32fb436220f9cbfde1965e9db5d1794 [0,1,0,0,0,0|2,0,1]=4 212 B21R1.97239 CCCCCC(=O)CCCC(=O)NCCc1sccc1C a8db4d862eaae7ad913c0ac8adbd3b82 [0,1,0,0,0,0|2,0,1]=4 213 B21R1.97239 CCCCCC(=O)CCCC(=O)NCCc1scnc1C 2a441b35a2f715ab4f38aef5bd1d6607 [0,1,0,0,0,0|1,0,1]=3 214 B21R1.97239 CCCCCC(O)CCCC(=O)NCCc1ccnn1C 17b3c5cce537143a9cd90a1e317c8eb5 [0,1,0,0,0,0|3,0,0]=4 215 B21R1.97239 CCCCCC(O)CCCC(=O)NCCc1sccc1C 54ed56cf739fd82ec183bae1efa7e277 [0,1,0,0,0,0|2,0,0]=3 216 B21R1.97239 CCCCCC(O)CCCC(=O)NCCc1scnc1C fdd54e192eefff32424e4046928d7bca [0,1,0,0,0,0|1,0,0]=2 217 B21R1.107231 CCCCCCCCC(O)C(=O)NCCc1ccnn1C bf3f0718175655df22002c72ba858822 [0,1,0,0,0,0|3,0,0]=4 218 B21R1.107231 CCCCCCCCC(O)C(=O)NCCc1sccc1C ce563c90147e67010bcd99c5b83ced54 [0,1,0,0,0,0|2,0,0]=3 219 B21R1.107231 CCCCCCCCC(O)C(=O)NCCc1scnc1C 5b34f7c56b4d8c59c38b8ba1be83bf03 [0,1,0,0,0,0|1,0,0]=2 220 B21R1.107231 CCCCCCCCN(C)C(=O)NCCc1sccc1C dadc1a7eb3c35c9d406c1224c1966b64 [0,1,0,0,0,0|3,0,0]=4 221 B21R1.107231 CCCCCCCCN(C)C(=O)NCCc1scnc1C b2d5bbb9de8230a9e2a4a22766b0cbe1 [0,1,0,0,0,0|2,0,0]=3 222 B21R1.107231 CCCCCCCCN(C)C(=S)NCCc1scnc1C 38030442668a461f4d70d41ad82c7879 [0,1,0,0,0,0|2,1,0]=4 223 B21R1.107231 CCCCCCCOC(C)C(=O)NCCc1sccc1C af2a6e10c7a61099ee44729f4e58de5e [0,1,0,0,0,0|3,0,0]=4 224 B21R1.107231 CCCCCCCOC(C)C(=O)NCCc1scnc1C 33e337d84b2e170690b9c612e368382c [0,1,0,0,0,0|2,0,0]=3 225 B21R1.107231 CNCCCCCCN(C)C(=O)NCCc1scnc1C 556f795f26946e33bbe4565477261312 [0,1,0,0,0,0|3,0,0]=4 226 B21R1.147754 CCCCCCC(=O)CCC(=O)NCCc1sccc1C 7f217bb8b57418dc09dc1697bae62ed2 [0,1,0,0,0,0|2,0,1]=4 227 B21R1.147754 CCCCCCC(=O)CCC(=O)NCCc1scnc1C 9b6402671416ad1c4820c8885d10dfab [0,1,0,0,0,0|1,0,1]=3 228 B21R1.147754 CCCCCCC(=O)NCC(=O)NCCc1scnc1C 9b0729bc0c997757c496025de296ba22 [0,1,0,0,0,0|2,0,1]=4 229 B21R1.314265 CCCCCCCC(O)CC(=O)NCCc1ccnn1C 9ef9c871e5d7d3569e31f70a5ff3a3f2 [0,1,0,0,0,0|3,0,0]=4 230 B21R1.314265 CCCCCCCC(O)CC(=O)NCCc1sccc1C 8589419ac69675f110fb9d29364df7da [0,1,0,0,0,0|2,0,0]=3 231 B21R1.314265 CCCCCCCC(O)CC(=O)NCCc1scnc1C 1c4a8ba1e52d3af27c7ec362e26fe666 [0,1,0,0,0,0|1,0,0]=2 232 B21R1.314265 CCCCCCC[C@@H](O)CC(=O)NCCc1ccnn1C 83a6ae5a4f0777df412a9d55b42e6ff2 [0,1,0,0,0,0|3,0,0]=4 233 B21R1.314265 CCCCCCC[C@@H](O)CC(=O)NCCc1sccc1C d136a594cf6826d17cd4b832eed1dd7d [0,1,0,0,0,0|2,0,0]=3 234 B21R1.314265 CCCCCCC[C@@H](O)CC(=O)NCCc1scnc1C 3e12c11a8f5fa22d5d22509e54194648 [0,1,0,0,0,0|1,0,0]=2 235 B21R1.314265 CCCCCCC[C@H](C)NC(=O)NCCc1scnc1C c8cf50f7048f5703dba710de02e58fc3 [0,1,0,0,0,0|2,0,0]=3 236 B21R1.314265 CCCCCCC[C@H](C)NC(=S)NCCc1scnc1C ceb055ff45807834c7065130efc07147 [0,1,0,0,0,0|2,1,0]=4 237 B21R1.695385 CCCCCCCCCC(=O)NCCc1c(noc1C)C 3b9dfef69c8244a882ca88bf88699ef9 [0,1,0,0,0,0|3,0,0]=4 238 B21R1.695385 CCCCCCCCCC(=O)OCNc1c(n[nH]c1C)C 961fa4c122cfcc98bf92e5f20170b688 [0,1,0,0,0,0|3,0,0]=4 239 B21R1.695385 CCCCCCCCCC(=O)OCNc1c(n[nH]c1Cl)C 93dbe9fcaebfe1ee2f5af944735a55a3 [0,1,0,0,0,0|3,0,0]=4 240 B21R1.695385 CCCCCCCCCC(=O)OCOc1c(n[nH]c1C)C 2c0c80a2f35a99b29d5a93cd6893ef03 [0,1,0,0,0,0|3,0,0]=4 241 B21R1.987150 C#CCCCCCCCC(=O)NCCc1sc(nc1C)C d1133e1e38eeef90feda8978f5370b4d [0,1,0,0,0,0|1,0,2]=4 242 B21R1.987150 C=CCCCCCCCC(=O)NCCc1sc(nc1C)C dde90412a545a6446fa31bf6a784d7fe [0,1,0,0,0,0|1,0,2]=4 243 B21R1.987150 CCCCC/C=C/CCC(=O)NCCc1sc(nc1C)C cf046ebf35261698aa0f30c672c57087 [0,1,0,0,0,0|1,0,2]=4 244 B21R1.987150 CCCCCC/C=C/CC(=O)NCCc1sc(nc1C)C 8331201404653ab2cb8bd0aa74a5c385 [0,1,0,0,0,0|1,0,2]=4 245 B21R1.987150 CCCCCC=CCCC(=O)NCCc1sc(nc1C)C d58851f74f06f0cc4bee01eaa20a792a [0,1,0,0,0,0|1,0,2]=4 246 B21R1.987150 CCCCCCC/C=C/C(=O)NCCc1sc(nc1C)C e07ec004d34e579474e49e9cb7ec47b9 [0,1,0,0,0,0|1,0,2]=4 247 B21R1.987150 CCCCCCC/C=C\C(=O)NCCc1sc(nc1C)C 5fc02db2b18dd3968641ca20ad61e8f7 [0,1,0,0,0,0|1,0,2]=4 248 B21R1.987150 CCCCCCC=CCC(=O)NCCc1sc(nc1C)C c9eba29cbf81a6614444698c2d3be0db [0,1,0,0,0,0|1,0,2]=4 249 B21R1.987150 CCCCCCCC=CC(=O)NCCc1sc(nc1C)C 004e49bbbe1f540d3ca61c448312d4db [0,1,0,0,0,0|1,0,2]=4 250 B21R1.987150 CCCCCCCCCC(=O)NCCc1cc(nn1C)C 48cce07c01fe94ecb344496180847ba8 [0,1,0,0,0,0|3,0,0]=4 251 B21R1.987150 CCCCCCCCCC(=O)NCCc1sc(nc1C)C 71d82e02f8276d69f35fa7fb52f9807a [0,1,0,0,0,0|1,0,0]=2 252 B21R1.987150 CCCCCCCCNC(=S)NCCc1sc(nc1C)C a4d490606b6673822b061cd4e3bea3bf [0,1,0,0,0,0|2,1,0]=4 253 B21R1.987150 CCCCOCCCNC(=O)NCCc1sc(nc1C)C f6ae4e9d50b78237b65272e0fcc69dbf [0,1,0,0,0,0|3,0,0]=4 254 B21R1.987150 CCCCOCCOCC(=O)NCCc1sc(nc1C)C 9a24197a724019dde1ea3ae5d443639a [0,1,0,0,0,0|3,0,0]=4 255 B21R1.987150 Cc1nc(c(s1)CCNC(=O)CCCCCCCC=O)C 84756ee0ba31034b70761fc004703df9 [0,1,0,0,0,0|2,0,1]=4 256 B21R1.987150 Cc1nc(c(s1)CCNC(=O)CCCCCCCCO)C 7cccacfc7f1076be0824b5530e457449 [0,1,0,0,0,0|2,0,0]=3 257 B21R1.987150 Cc1nc(c(s1)CCNC(=O)CCCCCCCCS)C 77c06130f090533f5cff1aaee4ec1aeb [0,1,0,0,0,0|2,0,0]=3 258 B21R1.987150 Cc1nc(c(s1)CCNC(=O)NCCCCCCCN)C 6f196a6641930c3b5be73cc022270355 [0,1,0,0,0,0|3,0,0]=4 259 B21R2.7812 Cc1ccsc1CCNC(=O)CCCC2CCCCC2 c7f26dc8004f6ea5f75bf6807cee5a60 [0,0,0,1,0,0|2,0,0]=3 260 B21R2.7812 Cc1ccsc1CCNC(=O)CCCN2CCCCC2 2d90dcf0b34115de6d5c3e3b62aae13c [0,0,0,1,0,0|3,0,0]=4 261 B21R2.7812 Cc1ccsc1CCNC(=O)NCCC2CCCCC2 62adc87be43839d1454cc50b3c3776f8 [0,0,0,1,0,0|3,0,0]=4 262 B21R2.7812 Cc1ncsc1CCNC(=O)CCCC2CCCCC2 ddd2e5118f62457067c8961af328befa [0,0,0,1,0,0|1,0,0]=2 263 B21R2.7812 Cc1ncsc1CCNC(=O)CCCN2CCCCC2 4fb49fe632b64901290fde9cd9dd9583 [0,0,0,1,0,0|2,0,0]=3 264 B21R2.7812 Cc1ncsc1CCNC(=O)CCCN2CCOCC2 ef3735686ccecf5fcd03c1095318a831 [0,0,0,1,0,0|3,0,0]=4 265 B21R2.7812 Cc1ncsc1CCNC(=O)CCOC2CCCCO2 67f4653831bfdb5181d8435ffafd6108 [0,0,0,1,0,0|3,0,0]=4 266 B21R2.7812 Cc1ncsc1CCNC(=O)COCC2CCCCO2 33456fe800e01bd234b308599145729d [0,0,0,1,0,0|3,0,0]=4 267 B21R2.7812 Cc1ncsc1CCNC(=O)NCCC2CCCCC2 6f88225f7625ee895b15a4b296541308 [0,0,0,1,0,0|2,0,0]=3 268 B21R2.7812 Cc1ncsc1CCNC(=O)NCCC2CCCCO2 b96823dfb915463a3d21f1e75345d63e [0,0,0,1,0,0|3,0,0]=4 269 B21R2.7812 Cc1ncsc1CCNC(=O)NCCC2CCOCC2 709fd56258f2f162b3e7ee70323df567 [0,0,0,1,0,0|3,0,0]=4 270 B21R2.7812 Cc1ncsc1CCNC(=O)NCCC2CCSCC2 ccdff88a4fefb699930058cff50bfe4c [0,0,0,1,0,0|3,0,0]=4 271 B21R2.7812 Cc1ncsc1CCNC(=O)NCCN2CCCCC2 d7344f0057dad6b3841483f2038de191 [0,0,0,1,0,0|3,0,0]=4 272 B21R2.7812 Cc1ncsc1CCNC(=S)NCCC2CCCCC2 7da0dfcea40c3f7b012e2210e514c3a3 [0,0,0,1,0,0|2,1,0]=4 273 B21R2.7812 Cc1ncsc1CNCC(=O)NCCC2CCCCC2 fcfc08b9924f71ecd1dbab54b33c357b [0,0,0,1,0,0|3,0,0]=4 274 B21R2.7812 Cc1ncsc1COCC(=O)NCCC2CCCCC2 94768d81e000862c553f4e81b78f3113 [0,0,0,1,0,0|3,0,0]=4 275 B21R2.7812 Cn1nccc1CCNC(=O)CCCC2CCCCC2 054c516ec48e1b08532ff3847ff7093a [0,0,0,1,0,0|3,0,0]=4 276 B21R2.60101 CCC1CCCCN1CC(=O)NCCc2sccc2C 6bac9614a25079f834700fc9217263f4 [0,0,0,1,0,0|3,0,0]=4 277 B21R2.60101 CCC1CCCCN1CC(=O)NCCc2scnc2C 5c94e492ff5ff86e609cf61a3d780898 [0,0,0,1,0,0|2,0,0]=3 278 B21R2.60101 CCC1COCCC1NC(=O)NCCc2scnc2C 5199adf1d454b34cf364b2c28d1d3c58 [0,0,0,1,0,0|3,0,0]=4 279 B21R2.60101 COC1CCCCC1NC(=O)NCCc2scnc2C c13dc2301f36991ed99918a471a3f4e3 [0,0,0,1,0,0|3,0,0]=4 280 B21R2.60101 CO[C@H]1CCCC[C@@H]1NC(=O)NCCc2scnc2C 754fa19596a5389b8848a8f7b8e9babf [0,0,0,1,0,0|3,0,0]=4 281 B21R2.60101 Cc1ncsc1CCNC(=O)N[C@@H]2CCCC[C@@H]2CO c417c2b1070fdfe643f7f65413cc7eca [0,0,0,1,0,0|3,0,0]=4 282 B21R2.60101 Cc1ncsc1CCNC(=O)N[C@@H]2CCCC[C@H]2CO 4577b72c5576cd8698641c018b444ab7 [0,0,0,1,0,0|3,0,0]=4 283 B21R2.60101 Cc1ncsc1CCNC(=O)N[C@H]2CCCC[C@H]2CO fd75e155d131956ddc88c5dd1ce66ef9 [0,0,0,1,0,0|3,0,0]=4 284 B21R2.65939 CCN1CCCC1CNC(=O)NCCc2scnc2C 8c50f92284e1983ac4037dc80c74a0cd [0,0,0,1,0,0|3,0,0]=4 285 B21R2.65939 CCN1CCC[C@@H]1CNC(=O)NCCc2scnc2C 96ae63916d40c1ccc6b252021c38e968 [0,0,0,1,0,0|3,0,0]=4 286 B21R2.65939 CCN1CCC[C@H]1CNC(=O)NCCc2scnc2C ef8a11c6d7b4157b537593882649d186 [0,0,0,1,0,0|3,0,0]=4 287 B21R2.107218 Cc1ccsc1CCNC(=O)CCN2CCCCC2C d1bfeb6396b806b7382c52690a118d1e [0,0,0,1,0,0|3,0,0]=4 288 B21R2.107218 Cc1ccsc1CCNC(=O)COC2CCCCC2C 4399fddb79088f9ecb6a2d8ee44d8f58 [0,0,0,1,0,0|3,0,0]=4 289 B21R2.107218 Cc1ccsc1CCNC(=O)NCC2CCCCC2C 20619ef3060faa2a97a595d96c73d941 [0,0,0,1,0,0|3,0,0]=4 290 B21R2.107218 Cc1ncsc1CCNC(=O)CCN2CCCCC2C eb2d12952474fc9d07e7759e8369939e [0,0,0,1,0,0|2,0,0]=3 291 B21R2.107218 Cc1ncsc1CCNC(=O)COC2CCCCC2C 50d7f6678729ec05ccd8da241b78e5a0 [0,0,0,1,0,0|2,0,0]=3 292 B21R2.107218 Cc1ncsc1CCNC(=O)NCC2CCCCC2C 2bc12b03a1ef7807b36ca9f3b2a9b60c [0,0,0,1,0,0|2,0,0]=3 293 B21R2.107218 Cc1ncsc1CCNC(=O)NCC2CCCCC2O 46290780d1f5e0313fe6ed27ef13eaf3 [0,0,0,1,0,0|3,0,0]=4 294 B21R2.107218 Cc1ncsc1CCNC(=O)NCC2CCCCN2C e5f08808857bf2fed25822e647744c67 [0,0,0,1,0,0|3,0,0]=4 295 B21R2.107218 Cc1ncsc1CCNC(=S)NCC2CCCCC2C 2198f1560e7928afa251b91bdd0d1cea [0,0,0,1,0,0|2,1,0]=4 296 B21R2.110491 Cc1ncsc1CCNC(=O)CCCCC2CCSS2 d9df80638513a66cfb316993b791862e [0,0,0,1,0,0|3,0,0]=4 297 B21R2.110491 Cc1ncsc1CCNC(=O)CCCCC2CSSC2 9b776a5647d22bd63b9284546f2dadaa [0,0,0,1,0,0|3,0,0]=4 298 B21R2.110491 Cc1ncsc1CCNC(=O)CCCC[C@@H]2CCSS2 8609d36b5494e3c7a32f06a4e0220ea3 [0,0,0,1,0,0|3,0,0]=4 299 B21R2.110491 Cc1ncsc1CCNC(=O)CCCC[C@H]2CCSS2 1bf956ce32517dfdfa720e9566ec6133 [0,0,0,1,0,0|3,0,0]=4 300 B21R2.110491 Cc1ncsc1CCNC(=O)NCCCC2CCCC2 4b9ec1097a67874793c4e8fe7f79e8cb [0,0,0,1,0,0|2,0,0]=3 301 B21R2.110491 Cc1ncsc1CCNC(=O)NCCCN2CCCC2 327d6022a937e699c26d5f88c8e20ffd [0,0,0,1,0,0|3,0,0]=4 302 B21R2.110491 Cc1ncsc1CCNC(=O)NCCOC2CCCC2 f1bc3a223f05b1b95e3d78b8f92641a0 [0,0,0,1,0,0|3,0,0]=4 303 B21R2.110491 Cc1ncsc1CCNC(=O)NCCSC2CCCC2 f57b653de1a801f55892a07c8f77d4b2 [0,0,0,1,0,0|3,0,0]=4 304 B21R2.110491 Cc1ncsc1CCNC(=S)NCCCC2CCCC2 81390de00a33dcfd6174a74818a9919b [0,0,0,1,0,0|2,1,0]=4 305 B21R2.275605 CCCN1CCCCC1C(=O)NCCc2sccc2C 10724405fa37d3810bf1a97d6641c973 [0,0,0,1,0,0|3,0,0]=4 306 B21R2.275605 CCCN1CCCCC1C(=O)NCCc2scnc2C 7c1822f303cf6f62f116fdb9e45725c3 [0,0,0,1,0,0|2,0,0]=3 307 B21R2.275605 COCC1CCCCN1C(=O)NCCc2scnc2C 5eb024d33828bfa90cac208b7736bb71 [0,0,0,1,0,0|3,0,0]=4 308 B21R2.280778 COC[C@@H]1CCC[C@@H]1NC(=O)NCCc2scnc2C 6a86c37973072fd631ad568f7e84b908 [0,0,0,1,0,0|3,0,0]=4 309 B21R2.280778 COC[C@H]1CCC[C@H]1NC(=O)NCCc2scnc2C 71bfb35648c535c46bc993f12fa1e697 [0,0,0,1,0,0|3,0,0]=4 310 B21R2.282337 C#CCCCCCCCC(=O)N1CCc2scnc2C1 c7024fa0db3a1b2500859a52a9de7b45 [0,0,0,1,0,0|1,0,2]=4 311 B21R2.282337 C=CCCCCCCCC(=O)N1CCc2scnc2C1 1938ca2d1c240e6e05a27cdf8867c876 [0,0,0,1,0,0|1,0,2]=4 312 B21R2.282337 CCCCC/C=C/CCC(=O)N1CCc2scnc2C1 21a80f967329b75e80f47513cdab893e [0,0,0,1,0,0|1,0,2]=4 313 B21R2.282337 CCCCCC/C=C/CC(=O)N1CCc2scnc2C1 99585f99941e38f1cd9f61f0891fef3d [0,0,0,1,0,0|1,0,2]=4 314 B21R2.282337 CCCCCC=CCCC(=O)N1CCc2scnc2C1 f4cc18113264e0862ee8ae65c7fe4414 [0,0,0,1,0,0|1,0,2]=4 315 B21R2.282337 CCCCCCC/C=C/C(=O)N1CCc2scnc2C1 c8a67b0af584df3a0ee47b9420f90d64 [0,0,0,1,0,0|1,0,2]=4 316 B21R2.282337 CCCCCCC/C=C\C(=O)N1CCc2scnc2C1 4f3f93c7f6c276e61fefa2039e13741b [0,0,0,1,0,0|1,0,2]=4 317 B21R2.282337 CCCCCCC=CCC(=O)N1CCc2scnc2C1 9ac4c8dce0c5a83a3c1f9db1f7bd531a [0,0,0,1,0,0|1,0,2]=4 318 B21R2.282337 CCCCCCCC=CC(=O)N1CCc2scnc2C1 5dcdcfd5e5071d68497330049eb9eb74 [0,0,0,1,0,0|1,0,2]=4 319 B21R2.282337 CCCCCCCCCC(=O)N1CCc2ncsc2C1 b4dd2e08a51ba7aa094e84ddd21a88ca [0,0,0,1,0,0|3,0,0]=4 320 B21R2.282337 CCCCCCCCCC(=O)N1CCc2occc2C1 5d358247e5f7de72051de1ead7f1e4b1 [0,0,0,1,0,0|2,1,0]=4 321 B21R2.282337 CCCCCCCCCC(=O)N1CCc2sccc2C1 23d9af741ec251ab11fa71bbdb958582 [0,0,0,1,0,0|2,0,0]=3 322 B21R2.282337 CCCCCCCCCC(=O)N1CCc2scnc2C1 14bfd67113b1780b8d64133cdf12dcd7 [0,0,0,1,0,0|1,0,0]=2 323 B21R2.282337 CCCCCCCCCC(=O)N1CCn2ccnc2C1 ac0aaa2cdbcf363d2b3138c8e7ab32ee [0,0,0,1,0,0|3,0,0]=4 324 B21R2.282337 CCCCCCCCCC(=O)N1CCn2ncnc2C1 bd23ddabf956fc0f52772393cda64d74 [0,0,0,1,0,0|3,0,0]=4 325 B21R2.282337 CCCCCCCCNC(=O)N1CCc2[nH]cnc2C1 58df06c992e3fe44c5cf5c8e4ab8926f [0,0,0,1,0,0|3,0,0]=4 326 B21R2.282337 CCCCCCCCNC(=O)N1CCc2sccc2C1 5fba68b4e4a7123b74b89dcc26ffba75 [0,0,0,1,0,0|3,0,0]=4 327 B21R2.282337 CCCCCCCCNC(=O)N1CCc2scnc2C1 fb3612a46288635705a4ea0dc7e45d1c [0,0,0,1,0,0|2,0,0]=3 328 B21R2.282337 CCCCCCCCNC(=S)N1CCc2scnc2C1 589590e289cfa6ae479a822302eb63cb [0,0,0,1,0,0|2,1,0]=4 329 B21R2.282337 CCCCCCCNCC(=O)N1CCc2sccc2C1 bc29e31f1d78fadb56611a172cf86c99 [0,0,0,1,0,0|3,0,0]=4 330 B21R2.282337 CCCCCCCOCC(=O)N1CCc2sccc2C1 b189121adaaad4f98a414078051baf34 [0,0,0,1,0,0|3,0,0]=4 331 B21R2.282337 CCCCCCNCCC(=O)N1CCc2sccc2C1 828f8fb9f62f5e0abdf114dc55133128 [0,0,0,1,0,0|3,0,0]=4 332 B21R2.282337 CCCCCCOCCC(=O)N1CCc2sccc2C1 568200b96fd48edace4d8642070648c0 [0,0,0,1,0,0|3,0,0]=4 333 B21R2.282337 CCCCOCCCNC(=O)N1CCc2scnc2C1 221409dd99798824272779ece2ba11cc [0,0,0,1,0,0|3,0,0]=4 334 B21R2.282337 CCCCOCCOCC(=O)N1CCc2scnc2C1 aaa05b74b11d9a5aeea4f5d72bee5be8 [0,0,0,1,0,0|3,0,0]=4 335 B21R2.282337 CCCSCCCCNC(=O)N1CCc2scnc2C1 078aa59571564c13aaf670b2b7b51d8a [0,0,0,1,0,0|3,0,0]=4 336 B21R2.282337 NCCCCCCCNC(=O)N1CCc2scnc2C1 29438ab4054c1ea3f0e82f33ddf1b6f2 [0,0,0,1,0,0|3,0,0]=4 337 B21R2.282337 O=C(CCCCCCCCO)N1CCc2sccc2C1 1ce462880da24b73f1ddfc840625f898 [0,0,0,1,0,0|3,0,0]=4 338 B21R2.282337 O=C(CCCCCCCCO)N1CCc2scnc2C1 7a3eebded9862715f5725e067d47e83e [0,0,0,1,0,0|2,0,0]=3 339 B21R2.282337 O=C(CCCCCCCCS)N1CCc2sccc2C1 ce00934ec5029a1cf07fd6adc0703f4b [0,0,0,1,0,0|3,0,0]=4 340 B21R2.282337 O=C(CCCCCCCCS)N1CCc2scnc2C1 7e40beefde6462fd156e722afd24f9f1 [0,0,0,1,0,0|2,0,0]=3 341 B21R2.282337 O=C(NCCCCCCCO)N1CCc2scnc2C1 0d2c931f8afdb361a04c22875917f959 [0,0,0,1,0,0|3,0,0]=4 342 B21R2.282337 O=CCCCCCCCC(=O)N1CCc2scnc2C1 4aa7b7824059067bd4d7859a04cb1e67 [0,0,0,1,0,0|2,0,1]=4 343 B21R2.397855 CCCCC1CCCN1C(=O)NCCc2sccc2C 04fb115db8ea0827c644abd8fbc23f60 [0,0,0,1,0,0|3,0,0]=4 344 B21R2.397855 CCCCC1CCCN1C(=O)NCCc2scnc2C 3ead39257e62eafb436f3678fe6cbc36 [0,0,0,1,0,0|2,0,0]=3 345 B21R2.397855 CCCCC1CCCN1C(=S)NCCc2scnc2C 56c719a2907679d95bd1c08929706f1e [0,0,0,1,0,0|2,1,0]=4 346 B21R2.397855 CCOCC1CCCN1C(=O)NCCc2scnc2C e353cf9ff54159797bcdbd0efe32140d [0,0,0,1,0,0|3,0,0]=4 347 B21R2.397855 CCOC[C@@H]1CCCN1C(=O)NCCc2scnc2C c8eca0b0d00a03a408b92b81a6fcfec6 [0,0,0,1,0,0|3,0,0]=4 348 B21R2.3300730 Cc1ccsc1CCNC(=O)N2CCCCCCCC2 4a963af89d3bdc87bfd897ec1a6eafeb [0,0,0,1,0,0|3,0,0]=4 349 B21R2.3300730 Cc1ncsc1CCNC(=O)N2CCCCCCCC2 f28c18bd2e5b697e1eccd1ab19e699c8 [0,0,0,1,0,0|2,0,0]=3 350 B21R2.3300730 Cc1ncsc1CCNC(=S)N2CCCCCCCC2 ed4bdb0df48038890b21b24600203f3f [0,0,0,1,0,0|2,1,0]=4 351 B21R2.3300756 Cc1ncsc1CCNC(=O)NCCCOCC2CC2 22e68f915d726d033864fdaded645189 [0,0,0,1,0,0|3,0,0]=4 352 B21R2.3303770 Cc1ccsc1CCNC(=O)CN2CCCCCCC2 a36384ee8fa67ed9509f716ec6372069 [0,0,0,1,0,0|3,0,0]=4 353 B21R2.3303770 Cc1ncsc1CCNC(=O)CN2CCCCCCC2 efa0222d3a8939290c335d4fc81bdd96 [0,0,0,1,0,0|2,0,0]=3 354 B21R2.3303770 Cc1ncsc1CCNC(=S)NC2CCCCCCC2 d2b828b65ce84209db9f764008119fc5 [0,0,0,1,0,0|2,1,0]=4 355 B21R2.3303770 Cc1ncsc1CNCC(=O)NC2CCCCCCC2 947f3ac11e06e9a79e648afd9d7821cb [0,0,0,1,0,0|3,0,0]=4 356 B21R2.3303770 Cc1ncsc1COCC(=O)NC2CCCCCCC2 9eddf4dd838bf7843072d9d11a13b5f9 [0,0,0,1,0,0|3,0,0]=4 357 B21R2.3526303 Cc1ccsc1CCNC(=O)CCN2CCCCCC2 6d5ad2969e72e4debd05bd5fef05656c [0,0,0,1,0,0|3,0,0]=4 358 B21R2.3526303 Cc1ccsc1CCNC(=O)NCC2CCCCCC2 176219c5e880621e92c90221206600c8 [0,0,0,1,0,0|3,0,0]=4 359 B21R2.3526303 Cc1ncsc1CCNC(=O)CCN2CCCCCC2 30a1ecd56559003b8ef06bc2a7d50c16 [0,0,0,1,0,0|2,0,0]=3 360 B21R2.3526303 Cc1ncsc1CCNC(=O)NCC2CCCCCC2 24341a8b8b92814dff2d8af7cd3386f2 [0,0,0,1,0,0|2,0,0]=3 361 B21R2.3526303 Cc1ncsc1CCNC(=S)NCC2CCCCCC2 965e73794555939c6f948fef886ca8c9 [0,0,0,1,0,0|2,1,0]=4 362 B21R2.3527109 Cc1ncsc1CCOC2CCCCCCCCCC2 2a369681875f818a6f898fd29993ffbd [0,0,0,1,0,0|1,0,1]=3 363 B19R1.30498 C#CCCCCCCCC(=O)NCc1scnc1C f1e33158e3d677e04f4f29e33eeeea8c [0,0,0,0,1,0|1,0,2]=4 364 B19R1.30498 C#CCCCCCCNC(=O)CCc1scnc1C 6a8c116c9fc26629a9dd52aecf85e03b [0,0,0,0,1,0|1,0,2]=4 365 B19R1.30498 C=CCCCCCCCC(=O)NCc1scnc1C 42e8266ad0398b09a80eb1f76eb6624d [0,0,0,0,1,0|1,0,2]=4 366 B19R1.30498 CCCCC/C=C/CCC(=O)NCc1scnc1C 93071ce37c7ed6b5f91e5faae649677a [0,0,0,0,1,0|1,0,2]=4 367 B19R1.30498 CCCCCC/C=C/CC(=O)NCc1scnc1C b8efceefb4575dbe95242322d3e51df1 [0,0,0,0,1,0|1,0,2]=4 368 B19R1.30498 CCCCCC=CCCC(=O)NCc1scnc1C 9172727302b887297ef900593ef8a744 [0,0,0,0,1,0|1,0,2]=4 369 B19R1.30498 CCCCCCC/C=C/C(=O)NCc1scnc1C e02c20c17da2519174d657bf27d4531b [0,0,0,0,1,0|1,0,2]=4 370 B19R1.30498 CCCCCCC/C=C\C(=O)NCc1scnc1C 8e3664be5e3f7b0ddf9001fe0e54a25a [0,0,0,0,1,0|1,0,2]=4 371 B19R1.30498 CCCCCCC=CCC(=O)NCc1scnc1C ca46d597d30582dd64bbf9a19bf0f8e0 [0,0,0,0,1,0|1,0,2]=4 372 B19R1.30498 CCCCCCCC=CC(=O)NCc1scnc1C 8b1d36892890dfa72641643499a22183 [0,0,0,0,1,0|1,0,2]=4 373 B19R1.30498 CCCCCCCCCC(=O)NCc1ccnn1C 593d969cc6ac7329f434eaf4f6aeb32e [0,0,0,0,1,0|3,0,0]=4 374 B19R1.30498 CCCCCCCCCC(=O)NCc1ccoc1C 75cc72f970ef4e52c0010ae058fc31fc [0,0,0,0,1,0|3,0,0]=4 375 B19R1.30498 CCCCCCCCCC(=O)NCc1conc1C 0f18196cf27fc943bd665b3e7c96ce2e [0,0,0,0,1,0|3,0,0]=4 376 B19R1.30498 CCCCCCCCCC(=O)NCc1ncnn1C 566bc5f5025a0347823ea2bea419e829 [0,0,0,0,1,0|3,0,0]=4 377 B19R1.30498 CCCCCCCCCC(=O)NCc1ncoc1C 4a602f9e41973f26cab828484fe33439 [0,0,0,0,1,0|3,0,0]=4 378 B19R1.30498 CCCCCCCCCC(=O)NCc1nonc1C 8e718c3edc1edac6736366968401373d [0,0,0,0,1,0|3,0,0]=4 379 B19R1.30498 CCCCCCCCCC(=O)NCc1occc1C 60abb2c19634382d9a6a70eb236a5955 [0,0,0,0,1,0|2,1,0]=4 380 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1Br 3dc2aec0b3ff70d6881032d8bfc0e26c [0,0,0,0,1,0|3,0,0]=4 381 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1Cl ec22cff864e4a43ba74a3e4972fc5a75 [0,0,0,0,1,0|3,0,0]=4 382 B19R1.30498 CCCCCCCCCC(=O)NCc1sccc1F b32a0bba709bd51c965ff95306a9b1f5 [0,0,0,0,1,0|3,0,0]=4 383 B19R1.30498 CCCCCCCCCC(=O)NCc1scnc1Br c1755a7f8c3d29304318143a9507703c [0,0,0,0,1,0|2,0,0]=3 384 B19R1.30498 CCCCCCCCCC(=O)NCc1scnc1C adb3df9102ff2a7c8278fe5d163412fd [0,0,0,0,1,0|1,0,0]=2 385 B19R1.30498 CCCCCCCCCC(=O)NCc1snnc1C c58af9c06c4172e21bbb02c3b4f72ea5 [0,0,0,0,1,0|2,0,0]=3 386 B19R1.30498 CCCCCCCCCC(C)OCc1scnc1Cl d285a285d03b57abc8cf9017d8bce601 [0,0,0,0,1,0|2,0,1]=4 387 B19R1.30498 CCCCCCCCC[C@@H](C)OCc1scnc1Cl 2658026a65b1c71ea4ebc2b69b49a2a5 [0,0,0,0,1,0|2,0,1]=4 388 B19R1.30498 CCCCCCCCNC(=O)CCc1ccnn1C 3e357a8469d50bead4ff0832f0c2ae18 [0,0,0,0,1,0|3,0,0]=4 389 B19R1.30498 CCCCCCCCNC(=O)CCc1sccc1Br f38346d19c5430e3231f09a9c9344296 [0,0,0,0,1,0|3,0,0]=4 390 B19R1.30498 CCCCCCCCNC(=O)CCc1sccc1C bf84ce8f016d52668408c7ad700577e6 [0,0,0,0,1,0|2,0,0]=3 391 B19R1.30498 CCCCCCCCNC(=O)CCc1scnc1C 41ff8b1a3be5f8a50bcb192c8778561e [0,0,0,0,1,0|1,0,0]=2 392 B19R1.30498 CCCCCCCCNC(=O)CCn1ccnc1C 30bae95b5e7aa175f3e34b03d97956c1 [0,0,0,0,1,0|3,0,0]=4 393 B19R1.30498 CCCCCCCCNC(=O)CSc1snnc1C 91b15687cbebce9ef2f999f5d76de281 [0,0,0,0,1,0|3,0,0]=4 394 B19R1.30498 CCCCCCCCNC(=O)NCc1scnc1Br 7b9bbb20acf3393b5580f12aa280b782 [0,0,0,0,1,0|3,0,0]=4 395 B19R1.30498 CCCCCCCCNC(=O)NCc1scnc1C 5303d629810708f192e74748d2799a51 [0,0,0,0,1,0|2,0,0]=3 396 B19R1.30498 CCCCCCCCNC(=O)NCc1snnc1C 9a67146860bb4da95c02de72862a05bd [0,0,0,0,1,0|3,0,0]=4 397 B19R1.30498 CCCCCCCCNC(=S)NCc1scnc1C b7334809dbd1f090369c856347a168ae [0,0,0,0,1,0|2,1,0]=4 398 B19R1.30498 CCCCOCCCNC(=O)CCc1sccc1C 2f9b9a91131b8844897e629e5573e1ba [0,0,0,0,1,0|3,0,0]=4 399 B19R1.30498 CCCCOCCCNC(=O)CCc1scnc1C 46d4afbe8c11710319dc679299edca8a [0,0,0,0,1,0|2,0,0]=3 400 B19R1.30498 CCCCOCCCNC(=O)NCc1scnc1C 485f0eb641cadf1241ae66c26beaf9c9 [0,0,0,0,1,0|3,0,0]=4 401 B19R1.30498 CCCCOCCOCC(=O)NCc1scnc1C b302dcfe95a745e603b37d0b05821531 [0,0,0,0,1,0|3,0,0]=4 402 B19R1.30498 CCCSCCCCNC(=O)CCc1sccc1C 65ab76d1f09f7a38d9c6f02a50ca8e54 [0,0,0,0,1,0|3,0,0]=4 403 B19R1.30498 CCCSCCCCNC(=O)CCc1scnc1C 1be5810be5d62b5089043f3a0618e5c3 [0,0,0,0,1,0|2,0,0]=3 404 B19R1.30498 CCCSCCCCNC(=O)NCc1scnc1C a6a7467a9df6d289702068d9226a1065 [0,0,0,0,1,0|3,0,0]=4 405 B19R1.30498 CCOCCOCCNC(=O)CCc1scnc1C 229d8dd73232f36fb7607f464e456538 [0,0,0,0,1,0|3,0,0]=4 406 B19R1.30498 COCCOCCCNC(=O)CCc1scnc1C fe838fd44503b1cd55ed3cfb4ab90e5e [0,0,0,0,1,0|3,0,0]=4 407 B19R1.30498 CSCCOCCCNC(=O)CCc1scnc1C 1874cb3ef6eeb7afc25894ef6c3a4aff [0,0,0,0,1,0|3,0,0]=4 408 B19R1.30498 Cc1ccsc1CCC(=O)NCCCCCCCO 4319968e9a39e9c7699b979173a1be00 [0,0,0,0,1,0|3,0,0]=4 409 B19R1.30498 Cc1ncsc1CCC(=O)NCCCCCCCO 0d3c2598a3b8d386de4dc43fb4e43d4d [0,0,0,0,1,0|2,0,0]=3 410 B19R1.30498 Cc1ncsc1CCC(=O)NCCCCSCCO 8a605b907003e841bec9c5124d18b1ac [0,0,0,0,1,0|3,0,0]=4 411 B19R1.30498 Cc1ncsc1CCC(=O)NCCCOCCCO 1b399f6b01e87efa42ffd1ccfe0659bc [0,0,0,0,1,0|3,0,0]=4 412 B19R1.30498 Cc1ncsc1CNC(=O)CCCCCCCC=O 61d771fac6073f8e98be91565202c796 [0,0,0,0,1,0|2,0,1]=4 413 B19R1.30498 Cc1ncsc1CNC(=O)CCCCCCCCO 732c23e184ebf5e0443922a19a996e7d [0,0,0,0,1,0|2,0,0]=3 414 B19R1.30498 Cc1ncsc1CNC(=O)CCCCCCCCS d1c7132251455a0d974afccfe211898c [0,0,0,0,1,0|2,0,0]=3 415 B19R1.30498 Cc1ncsc1CNC(=O)NCCCCCCCN b7ea932e0527c707a808b8d96044abc4 [0,0,0,0,1,0|3,0,0]=4 416 B19R1.30498 Cc1ncsc1CNC(=O)NCCCCCCCO 3fe813cb2cdbac600f4f1c8e70bdccf4 [0,0,0,0,1,0|3,0,0]=4 417 B19R1.30498 Cc1nnsc1CNC(=O)CCCCCCCCO 53e37b69a3eda10cd070e6a3b5663ef6 [0,0,0,0,1,0|3,0,0]=4 418 B19R1.30498 Cc1nnsc1CNC(=O)CCCCCCCCS 0166adafffe97dec9fcd7c315c9441d2 [0,0,0,0,1,0|3,0,0]=4 419 B19R1.30498 O=C(CCCCCCCCO)NCc1scnc1Br 139b7155ad1ebd36c7b30b65e37afa9f [0,0,0,0,1,0|3,0,0]=4 420 B19R1.30498 O=C(CCCCCCCCS)NCc1scnc1Br 9e67733f224d5feebc045f0fc18fb3c6 [0,0,0,0,1,0|3,0,0]=4 421 B21R1.19508 C#CCCCCCCCC(=O)NCCCc1scnc1C 4524d2cdeb781ca04990bced8fa9ccb6 [0,0,0,0,0,1|1,0,2]=4 422 B21R1.19508 C=CCCCCCCCC(=O)NCCCc1scnc1C e6da71566fc209daa336383611701a18 [0,0,0,0,0,1|1,0,2]=4 423 B21R1.19508 CCCCC/C=C/CCC(=O)NCCCc1scnc1C 7f80592e5c59df93ce64b16c8fa0a198 [0,0,0,0,0,1|1,0,2]=4 424 B21R1.19508 CCCCCC/C=C/CC(=O)NCCCc1scnc1C ed35f7e6fb0318d982c4f6387766eade [0,0,0,0,0,1|1,0,2]=4 425 B21R1.19508 CCCCCC=CCCC(=O)NCCCc1scnc1C 804d88788770c1d03a52864ace3a2a14 [0,0,0,0,0,1|1,0,2]=4 426 B21R1.19508 CCCCCCC/C=C/C(=O)NCCCc1scnc1C e5b5d404f10a2b17638067c6be7aa2e2 [0,0,0,0,0,1|1,0,2]=4 427 B21R1.19508 CCCCCCC/C=C\C(=O)NCCCc1scnc1C 94dc06851fbb47a4a3cc86d733e732bd [0,0,0,0,0,1|1,0,2]=4 428 B21R1.19508 CCCCCCC=CCC(=O)NCCCc1scnc1C 3b57be1de04d305356a6c1e492ce6551 [0,0,0,0,0,1|1,0,2]=4 429 B21R1.19508 CCCCCCCC=CC(=O)NCCCc1scnc1C b7dc5f7e9364c5c4bf63aa5b17e2b2a5 [0,0,0,0,0,1|1,0,2]=4 430 B21R1.19508 CCCCCCCCCC(=O)NCCCc1scnc1C 19dbdabbee768e0cd46487440e381a54 [0,0,0,0,0,1|1,0,0]=2 431 B21R1.19508 CCCCCCCCCC(=O)NCCCn1ccnc1C 3b52a706dde7ca7965011198414d0023 [0,0,0,0,0,1|3,0,0]=4 432 B21R1.19508 CCCCCCCCCC(=O)OCNCc1cccn1C ffa77b0a0a5c4f6e986a1ef38e847810 [0,0,0,0,0,1|3,0,0]=4 433 B21R1.19508 CCCCCCCCCC(=O)OCNCc1cn[nH]c1C 92548263c79a551e2884b87200a5d062 [0,0,0,0,0,1|2,0,1]=4 434 B21R1.19508 CCCCCCCCCC(=O)OCNCc1nonc1C 3799b4999a09e7d0ef203ed021cfc089 [0,0,0,0,0,1|2,0,0]=3 435 B21R1.19508 CCCCCCCCCC(=O)OCOCc1c[nH]nc1C 1ecae6ea7ec3a8780f3d72c7370e3b90 [0,0,0,0,0,1|2,0,0]=3 436 B21R1.19508 CCCCCCCCCC(=O)OCOCc1cccn1C 26e1ee7fe162ab5842a8dd7898bda662 [0,0,0,0,0,1|3,0,0]=4 437 B21R1.19508 CCCCCCCCCC(=O)OCOCc1ccnn1C 788a924f8cb8c42a0eb8c662930667bb [0,0,0,0,0,1|2,0,0]=3 438 B21R1.19508 CCCCCCCCCC(=O)OCOCc1ccoc1C 91346019db34d1b236e4d4a32a56ace3 [0,0,0,0,0,1|2,0,0]=3 439 B21R1.19508 CCCCCCCCCC(=O)OCOCc1cscc1C f5c50b13eaf3d156cb9b3120e9d3a096 [0,0,0,0,0,1|3,0,0]=4 440 B21R1.19508 CCCCCCCCCC(=O)OCOCc1n[nH]cc1C 67b40013c4a389789887a3eb0ea44f16 [0,0,0,0,0,1|3,0,0]=4 441 B21R1.19508 CCCCCCCCCC(=O)OCOCc1nccn1C 1da0a57984e06dabd8e486ff008887b2 [0,0,0,0,0,1|3,0,0]=4 442 B21R1.19508 CCCCCCCCCC(=O)OCOCc1ncnn1C e3c2a2d3f18bfb0f536a4e6a661515d6 [0,0,0,0,0,1|2,0,0]=3 443 B21R1.19508 CCCCCCCCCC(=O)OCOCc1nnnn1C 2ffdd66b1a9d8611f4e8a61c68039947 [0,0,0,0,0,1|3,0,0]=4 444 B21R1.19508 CCCCCCCCCC(=O)OCOCc1nonc1C 7e0a598734c4037061269507513736cd [0,0,0,0,0,1|2,0,0]=3 445 B21R1.19508 CCCCCCCCCC(=O)OCOCc1occc1C 6fd3fc42922bc93380b18cf188774ae4 [0,0,0,0,0,1|1,1,0]=3 446 B21R1.19508 CCCCCCCCCC(=O)OCOCc1ocnc1C a36d0e8b88f3bcd859afc064b7e1d2b7 [0,0,0,0,0,1|0,1,0]=2 447 B21R1.19508 CCCCCCCCCC(=O)OCOCc1sccc1Cl 968e7e05fb0ba9dfac6431de9baed550 [0,0,0,0,0,1|2,0,0]=3 448 B21R1.19508 CCCCCCCCCC(=O)OCOCc1scnc1C f81a9907d6d6be0499309836fc23e85a [0,0,0,0,0,1|0,0,0]=1 449 B21R1.19508 CCCCCCCCCC(=O)OCOCc1snnc1C de442b7e3ecb329d6bb7c5a20d9249ac [0,0,0,0,0,1|1,0,0]=2 450 B21R1.19508 CCCCCCCCNC(=O)NCCCc1scnc1C 4d53fdd471c8dba6c27208c96ae165c5 [0,0,0,0,0,1|2,0,0]=3 451 B21R1.19508 CCCCCCCCNC(=S)NCCCc1scnc1C c08cf4ebe9792d55271b1ab73d34ed2f [0,0,0,0,0,1|2,1,0]=4 452 B21R1.19508 CCCCOCCCNC(=O)NCCCc1scnc1C bbfeb6ea2da68e2660a5cb98ea5eed0c [0,0,0,0,0,1|3,0,0]=4 453 B21R1.19508 CCCCOCCOCC(=O)NCCCc1scnc1C 7046b0a80247ea9c181a7b92b04ba1b9 [0,0,0,0,0,1|3,0,0]=4 454 B21R1.19508 CCCSCCCCNC(=O)NCCCc1scnc1C f312c56978a0aaabf000762877e8f7ba [0,0,0,0,0,1|3,0,0]=4 455 B21R1.19508 Cc1ncsc1CCCNC(=O)CCCCCCCC=O 3a2ff80279e8563de54f02d4306e07f3 [0,0,0,0,0,1|2,0,1]=4 456 B21R1.19508 Cc1ncsc1CCCNC(=O)CCCCCCCCO 99cb9785a2ec1818f5315976809c971a [0,0,0,0,0,1|2,0,0]=3 457 B21R1.19508 Cc1ncsc1CCCNC(=O)CCCCCCCCS 2a1cfe83a8e9f3b5086b7deaeb7937e7 [0,0,0,0,0,1|2,0,0]=3 458 B21R1.19508 Cc1ncsc1CCCNC(=O)NCCCCCCCN 5977a98b54c001b156bf7db1cbb86816 [0,0,0,0,0,1|3,0,0]=4 459 B21R1.19508 Cc1ncsc1CCCNC(=O)NCCCCCCCO 79c766576b86a735d6ef39d2f23b50e3 [0,0,0,0,0,1|3,0,0]=4 460 B21R1.66577 CCCCCCCCCC(=O)NCCc1cccc(c1)C 6ccdb1f6791bcf6a98d4811e8d90de4b [0,0,0,0,0,1|3,0,0]=4 461 B21R1.66577 CCCCCCCCCC(=O)NCCc1cccc(n1)C 55e58a28438b86b2ef8a0b071ee0233c [0,0,0,0,0,1|3,0,0]=4 462 B21R1.66577 CCCCCCCCCC(=O)NCCc1ccnc(c1)C d421f12d18fe4c0058dd9364857e32f3 [0,0,0,0,0,1|2,0,0]=3 463 B21R1.66577 CCCCCCCCCC(=O)OCNc1ccnc(c1)Cl 9cc566aa4341467385421ba60026a241 [0,0,0,0,0,1|3,0,0]=4 464 B21R1.66577 CCCCCCCCCC(=O)OCOc1cccc(c1)C e4e1d8e6a3c1b5ab5dc482dbea76083d [0,0,0,0,0,1|3,0,0]=4 465 B21R1.66577 CCCCCCCCCC(=O)OCOc1cccc(n1)C 2b53c58632716792839df030ade30b5e [0,0,0,0,0,1|3,0,0]=4 466 B21R1.66577 CCCCCCCCCC(=O)OCOc1ccnc(c1)Cl b91e31bd9c7f331235cf0ae6a40b82a5 [0,0,0,0,0,1|3,0,0]=4 467 B21R1.66577 CCCCCCCCCC(=O)OCOc1ccnc(c1)F 57523d05415ac1e3c1a4210ac0094f31 [0,0,0,0,0,1|3,0,0]=4 468 B21R1.66577 CCCCCCCCNC(=O)NCCc1ccnc(c1)C d955edd5a4dbffd4dd10097fa0b2dd99 [0,0,0,0,0,1|3,0,0]=4 469 B21R1.66577 Cc1cc(ccn1)CCNC(=O)CCCCCCCCO bd6c96e81677b0431c3d6293b6d894a8 [0,0,0,0,0,1|3,0,0]=4 470 B21R1.66577 Cc1cc(ccn1)CCNC(=O)CCCCCCCCS c1c50121c5405ed98e1ad1f49ffa5f31 [0,0,0,0,0,1|3,0,0]=4 471 B21R1.78153 CCCCCCCCCC(=O)NCCc1ccccc1C 3424974ee20b30dfb89cbdf9d363b569 [0,0,0,0,0,1|3,0,0]=4 472 B21R1.78153 CCCCCCCCCC(=O)NCCc1ncccc1C dbbeb04bd2ef3c878bdedd5f464200bb [0,0,0,0,0,1|3,0,0]=4 473 B21R1.78153 CCCCCCCCCC(=O)OCOc1cccnc1C d2b6c0ea3877bd92832f34c0f1015835 [0,0,0,0,0,1|2,0,0]=3 474 B21R1.78153 CCCCCCCCCC(=O)OCOc1ccncc1Br 1d0575f24dc54cc8707f236a301fc30b [0,0,0,0,0,1|3,0,0]=4 475 B21R1.78153 CCCCCCCCCC(=O)OCOc1ccncc1F 70c94fdd8ce73ca67ab7eba2fb12fe67 [0,0,0,0,0,1|3,0,0]=4 476 B21R1.78153 CCCCCCCCCC(=O)OCOc1ncccc1C 3d6110290c5a2de6346763d32b080e78 [0,0,0,0,0,1|3,0,0]=4 477 B21R1.78153 CCCCCCCCCC(=O)OCOc1nccnc1Br 0d24fa09fbab9d749bd9488cbf5879a2 [0,0,0,0,0,1|3,0,0]=4 478 B21R1.78153 CCCCCCCCCC(=O)OCOc1nccnc1C f426bd0ccbeebd8291e2d8d9b7c0265f [0,0,0,0,0,1|2,0,0]=3 479 B21R1.78153 CCCCCCCCCC(=O)OCOc1ncncc1Cl bed30d13d49472ffc64f12676c4b181a [0,0,0,0,0,1|3,0,0]=4 480 B21R1.78153 CCCCCCCCCC(=O)OCOc1ncncc1F b90eabfdd48b3b30e7ac24ccff8ed516 [0,0,0,0,0,1|3,0,0]=4 481 B21R1.78153 CCCCCCCCCC(=O)OCOc1nnccc1C 8f074b2574844cae98cc7f079a569096 [0,0,0,0,0,1|3,0,0]=4 482 B18R1.292 CCCCCCCCCCOCCc1cccs1 32b16251bb173af319d9556df9cd8d9f [2,0,0,0,0,0|1,0,1]=4 483 B18R1.21875 CCCCCCCCC(=O)NCCc1cccs1 fc1081d21ac848aa0c5d817407d1a29c [2,0,0,0,0,0|2,0,0]=4 484 B18R1.21875 CCCCCCCCC(=O)NCCc1nncs1 045d7a91c889866ac8fda82f1f0e747f [2,0,0,0,0,0|2,0,0]=4 485 B18R1.21916 C#CCCCCCCCOCCc1scnc1C 8e0ee01dfefdbcbb0f15ff79161ee88c [2,0,0,0,0,0|0,0,2]=4 486 B18R1.21916 C=CCCCCCCCOCCc1scnc1C 0341a2955547c2ea8528ca9d5de7626a [2,0,0,0,0,0|0,0,2]=4 487 B18R1.21916 CC/C=C\CCCCCOCCc1scnc1C d4d717efec3ee6f3239a99c9e5d630e2 [2,0,0,0,0,0|0,0,2]=4 488 B18R1.21916 CCC=CCCCCCOCCc1scnc1C 92a7a2ef1713f1ac70964dc51e59c73b [2,0,0,0,0,0|0,0,2]=4 489 B18R1.21916 CCCCC/C=C\CCOCCc1scnc1C 7c8504e49cc820f0ead89ed21e33234e [2,0,0,0,0,0|0,0,2]=4 490 B18R1.21916 CCCCCC#CCCOCCc1scnc1C 4ab5d7edc8ec28d3e49111fd5287ef08 [2,0,0,0,0,0|0,0,2]=4 491 B18R1.21916 CCCCCC/C=C/COCCc1scnc1C 8ae3626c64a6ab913eb1801202725767 [2,0,0,0,0,0|0,0,2]=4 492 B18R1.21916 CCCCCC/C=C\COCCc1scnc1C 13a8a9830cdc89647f92a79e10dd711d [2,0,0,0,0,0|0,0,2]=4 493 B18R1.21916 CCCCCCC#CCOCCc1scnc1C 68173292fa7106c49585fc7b3acf9b66 [2,0,0,0,0,0|0,0,2]=4 494 B18R1.21916 CCCCCCCCCCCNc1scnc1C 09d075416f869d768f726e88f88e2765 [2,0,0,0,0,0|1,0,1]=4 495 B18R1.21916 CCCCCCCCCCNCc1scnc1C dcc96da4e18818bf676425e3c7a2c167 [2,0,0,0,0,0|1,0,1]=4 496 B18R1.21916 CCCCCCCCCCOCc1ocnc1C 7ad071e7c801cde62da367d23a7c46d1 [2,0,0,0,0,0|0,1,1]=4 497 B18R1.21916 CCCCCCCCCCOCc1sccc1C 3e6ce42651d36b532ebde2d0adbbf02f [2,0,0,0,0,0|1,0,1]=4 498 B18R1.21916 CCCCCCCCCCOCc1scnc1Br 84788631c74993b4bda9a4d8d0e67bcd [2,0,0,0,0,0|1,0,1]=4 499 B18R1.21916 CCCCCCCCCCOCc1scnc1C 920a55f98a3af7c795537cb5d50b87cc [2,0,0,0,0,0|0,0,1]=3 500 B18R1.21916 CCCCCCCCCCOCc1scnc1Cl e48a0c4bb6a73a12ee8713caab0bb24b [2,0,0,0,0,0|1,0,1]=4 501 B18R1.21916 CCCCCCCCCCOCc1snnc1C a678936c50284175e4fef52e383332a8 [2,0,0,0,0,0|1,0,1]=4 502 B18R1.21916 CCCCCCCCCNCCc1sccc1C 728742e595a3724e478d3b4a1c959c84 [2,0,0,0,0,0|2,0,0]=4 503 B18R1.21916 CCCCCCCCCNCCc1scnc1C 008f8f646cf274cc2004e1cb4ef6bc61 [2,0,0,0,0,0|1,0,0]=3 504 B18R1.21916 CCCCCCCCCOCCc1ncsc1C 60a0fb256f78246fc41b53a9f63c6533 [2,0,0,0,0,0|2,0,0]=4 505 B18R1.21916 CCCCCCCCCOCCc1scnc1C df2b7ac04c28093e44c05b86985f3731 [2,0,0,0,0,0|0,0,0]=2 506 B18R1.21916 CCCCCCCCCOCCn1ccnc1C 6ec501074fdb7962164cb76af7230047 [2,0,0,0,0,0|2,0,0]=4 507 B18R1.21916 CCCCCCCCNCCCc1scnc1C a7b2c72ac754818350a341232982f9ce [2,0,0,0,0,0|1,0,1]=4 508 B18R1.21916 CCCCCCCCOCCCc1scnc1C 599ab10a0dba50d7f43c7e34799c56e0 [2,0,0,0,0,0|1,0,1]=4 509 B18R1.21916 CCCCCCOCCOCCc1scnc1C 74d395e8976f43490309c692e16a7d68 [2,0,0,0,0,0|1,0,0]=3 510 B18R1.21916 CCCCCOCCCOCCc1scnc1C 01bdcb9b9cb0bd786de04467d9ea4283 [2,0,0,0,0,0|1,0,0]=3 511 B18R1.21916 COCCCOCCCOCCc1scnc1C 6a4adc028fc3ff45b7278f95e03dd00c [2,0,0,0,0,0|2,0,0]=4 512 B18R1.21916 Cc1ncsc1CCNCCCCCCCCO 07f6f7e2b271bd1e459518782a1361ba [2,0,0,0,0,0|2,0,0]=4 513 B18R1.21916 Cc1ncsc1COCCCCCCCCCS fab29b5427453513523a9b03c3d695c4 [2,0,0,0,0,0|1,0,1]=4 514 B18R1.23582 CCCCCCCC(=O)NCCc1sccc1C 353551fb84a06c819da0d34244a5ae03 [2,0,0,0,0,0|2,0,0]=4 515 B18R1.23582 CCCCCCCC(=O)NCCc1scnc1C a94b4d7dc4fc532c03e2b6ee1278cc76 [2,0,0,0,0,0|1,0,0]=3 516 B18R1.23582 CCCCCCCC(C)OCCc1scnc1C d1a9fb578b4601afaa89e52531fc15c2 [2,0,0,0,0,0|1,0,1]=4 517 B18R1.23582 CCCCOCCC(=O)NCCc1scnc1C c37578e438cafe45a853c44ce88b61d3 [2,0,0,0,0,0|2,0,0]=4 518 B18R1.23582 CCOCCCCC(=O)NCCc1scnc1C bf911ede83429de4da1ccebc4bb3ed96 [2,0,0,0,0,0|2,0,0]=4 519 B18R1.23582 COCCCCCC(=O)NCCc1scnc1C f51ddf16e2fb614e84278f69535c9130 [2,0,0,0,0,0|2,0,0]=4 520 B18R1.23582 Cc1ncsc1CCNC(=O)CCCCCCF 139c9c9958ca1ac14abf44024f10b491 [2,0,0,0,0,0|2,0,0]=4 521 B18R1.23582 Cc1ncsc1CCNC(=O)CCCCCCO 276c89f6eb447a29c416a74636aa13b2 [2,0,0,0,0,0|2,0,0]=4 522 B18R1.23582 Cc1ncsc1CCNC(=O)CCCCCCS 17a3106a9eb3f8316e28b09494853cd7 [2,0,0,0,0,0|2,0,0]=4 523 B20R1.8390 CCCCCCCCCC(=O)NCC(O)c1cccs1 40681a32ff0440d47b665a8e86e9ee6a [1,1,0,0,0,0|2,0,0]=4 524 B20R1.36449 CCCCCCCCCC(=O)N(C)CCc1cccs1 e3364cb379ea1e0d3c2ccd2bbe2262c3 [1,1,0,0,0,0|2,0,0]=4 525 B20R1.57916 CCCCCCCCCC(=O)NCCc1ccc(s1)Br f9f0d79b8468f3eb44689330f808a7cd [1,1,0,0,0,0|2,0,0]=4 526 B20R1.57916 CCCCCCCCCC(=O)NCCc1ccc(s1)C 7b8165dd9c9ef2bbc96b0f4f6eded275 [1,1,0,0,0,0|2,0,0]=4 527 B20R1.59018 CCCCCCCC(O)CC(=O)NCCc1cccs1 ec13ef5f72645ba2d92e3066db215940 [1,1,0,0,0,0|2,0,0]=4 528 B20R1.59018 CCCCCCCC(O)CC(=O)NCCc1nncs1 af2179e1fa79caf603374c694b0d8253 [1,1,0,0,0,0|2,0,0]=4 529 B20R1.59018 CCCCCCC[C@@H](O)CC(=O)NCCc1cccs1 8d89a682cb5fba87e9d15eb0568dc5fd [1,1,0,0,0,0|2,0,0]=4 530 B20R1.59018 CCCCCCC[C@@H](O)CC(=O)NCCc1nncs1 84944d4bfacef3d9a5e1a2d2dd01226d [1,1,0,0,0,0|2,0,0]=4 531 B20R1.62733 CCC(C)CCCCCCC(=O)NCCc1cccs1 529793b200c093251c9a99d098706915 [1,1,0,0,0,0|2,0,0]=4 532 B20R1.62733 CCC(C)CCCCCCC(=O)NCCc1nncs1 af22d98390c141137a9db68a423a50ff [1,1,0,0,0,0|2,0,0]=4 533 B20R1.65916 CCCCCCCCCCC(=O)NCCc1cccs1 9eabe5cd9a3f492cdd246005e85c86da [1,1,0,0,0,0|2,0,0]=4 534 B20R1.65916 CCCCCCCCCCC(=O)NCCc1nncs1 b2c818e22b3d4f13064e16476ba8c0a5 [1,1,0,0,0,0|2,0,0]=4 535 B20R1.65916 CCCCCCCCCNC(=O)CCCc1cccs1 ee8dae590bb140443c560cd7b3d2a49c [1,1,0,0,0,0|2,0,0]=4 536 B20R1.65916 CCCCCCCCCNC(=O)NCCc1nncs1 3b9b151241840dbfa18ac3bf77b78b8d [1,1,0,0,0,0|2,0,0]=4 537 B20R1.65916 CCCCCCCCNCC(=O)NCCc1cccs1 0ae929ff232ecb3fa5223e7f3f6bd67e [1,1,0,0,0,0|2,0,0]=4 538 B20R1.65916 CCCCCCCCOCC(=O)NCCc1cccs1 efe8f9cf4f68c2bbddf1974021cf5dc3 [1,1,0,0,0,0|2,0,0]=4 539 B20R1.65916 CCCCCCCCOCC(=O)NCCc1nncs1 1238549cb61e8aba0cbf9e787988027f [1,1,0,0,0,0|2,0,0]=4 540 B20R1.65916 CCCCCCCNCCC(=O)NCCc1cnc[nH]1 dee626b014461f734a301e067c9955c5 [1,1,0,0,0,0|2,0,0]=4 541 B20R1.65916 O=C(CCCCCCCCCF)NCCc1cccs1 393a77ab05e3aa79fbbfcf4116a8bb99 [1,1,0,0,0,0|2,0,0]=4 542 B20R1.65916 O=C(CCCCCCCCCF)NCCc1nncs1 eaeb24e5312f23e0f08ab9b99be23b8a [1,1,0,0,0,0|2,0,0]=4 543 B20R1.65916 O=C(CCCCCCCCCO)NCCc1cccs1 8fc94130f9becc6840bc1d3dc1dce6e7 [1,1,0,0,0,0|2,0,0]=4 544 B20R1.65916 O=C(CCCCCCCCCO)NCCc1nncs1 d063c8ec3a597814668d1a94eb025774 [1,1,0,0,0,0|2,0,0]=4 545 B20R1.68344 CCCCCCCCC(O)C(=O)NCCc1cccs1 8230f54562b31e959ca6d14ae9e374b2 [1,1,0,0,0,0|2,0,0]=4 546 B20R1.68344 CCCCCCCCC(O)C(=O)NCCc1nncs1 b2be22d35aa6652d8f24b47e55f7f6a1 [1,1,0,0,0,0|2,0,0]=4 547 B20R1.82979 CCCCCC(O)CCCC(=O)NCCc1cccs1 c1a92fe65ffb04ae18b007c3adc3fda7 [1,1,0,0,0,0|2,0,0]=4 548 B20R1.82979 CCCCCC(O)CCCC(=O)NCCc1nncs1 356da535ae11aadc1afa6ddc0b4f412a [1,1,0,0,0,0|2,0,0]=4 549 B20R1.10126 Cc1ncsc1CCOCCCCCCCCC(C)C db3ca337b36c16728a7f69534e683d74 [1,1,0,0,0,0|0,0,1]=3 550 B20R1.10126 Cc1ncsc1CCOCCCCCCCCN(C)C 700adda0adc30a0702bcfe88867dcaee [1,1,0,0,0,0|1,0,1]=4 551 B20R1.16861 CCCCCCCCCCNCCc1sc(nc1C)C 333d7a7ee6006c2c302fe15ee63c8866 [1,1,0,0,0,0|1,0,1]=4 552 B20R1.16861 CCCCCCCCCCOCCc1sc(nc1C)C 7dc37040a290c192106b30f4fee96e94 [1,1,0,0,0,0|0,0,1]=3 553 B20R1.61279 CCCCCCCCCNC(=O)CCc1scnc1C cef39addda7e47018ecae0be44e56f4e [1,1,0,0,0,0|2,0,0]=4 554 B20R1.65958 C#CCCCCCCCCCOCCc1scnc1C 86ccf3ba19b692d870371cc76186fdd2 [1,1,0,0,0,0|0,0,2]=4 555 B20R1.65958 C=CCCCCCCCCCOCCc1scnc1C 50e74140862659517b2fda20a7fefe6d [1,1,0,0,0,0|0,0,2]=4 556 B20R1.65958 CCCCCCCC/C=C/COCCc1scnc1C b76d376e2b996b32fd9376b9e2651dde [1,1,0,0,0,0|0,0,1]=3 557 B20R1.65958 CCCCCCCC/C=C\CCOCc1scnc1C 3b1de233a37d085e26f7dbb66754a4e8 [1,1,0,0,0,0|1,0,1]=4 558 B20R1.65958 CCCCCCCCC/C=C/COCc1scnc1C 553aa33dfb385506643a9dd88be296a1 [1,1,0,0,0,0|1,0,0]=3 559 B20R1.65958 CCCCCCCCC/C=C/COCc1snnc1C df48c62e3221076253c053bc595bdc9f [1,1,0,0,0,0|2,0,0]=4 560 B20R1.65958 CCCCCCCCCC=CCOCc1scnc1C 7b66816887147867a44888361c439c30 [1,1,0,0,0,0|1,0,0]=3 561 B20R1.65958 CCCCCCCCCC=CCOCc1snnc1C 3203c73cf2191da29738cfca31b3b58c [1,1,0,0,0,0|2,0,0]=4 562 B20R1.65958 CCCCCCCCCCCCNCc1scnc1C 3cd74d664308604e19974d46959b21ef [1,1,0,0,0,0|1,0,1]=4 563 B20R1.65958 CCCCCCCCCCCCOCc1scnc1C 4a106e69066eafc5fbaad2e8472207ac [1,1,0,0,0,0|1,0,1]=4 564 B20R1.65958 CCCCCCCCCCCNCCc1scnc1C 5a1c83b349ed1e8d7a39c45c9ffce67a [1,1,0,0,0,0|1,0,1]=4 565 B20R1.65958 CCCCCCCCCCCOCCc1scnc1C 6240db6bd621b9edfc9dca8813e74217 [1,1,0,0,0,0|0,0,1]=3 566 B20R1.65958 CCCCCCCCCCNCCCc1scnc1C a6831b1492051753ab00f0a485e8a7cf [1,1,0,0,0,0|1,0,1]=4 567 B20R1.65958 CCCCCCCCCCOCCCc1scnc1C 41ca77cfa27f6e505a7c62952ca40f0e [1,1,0,0,0,0|0,0,1]=3 568 B20R1.65958 CCCCCCCCOCCOCCc1scnc1C 1328ec8be8b1ec7291b002346057c43e [1,1,0,0,0,0|0,0,1]=3 569 B20R1.65958 CCCCCCCCOCOCCCc1scnc1C 0da022cb89dfb5df3c44d1d919121625 [1,1,0,0,0,0|1,0,1]=4 570 B20R1.65958 CCCCCCCCSCCOCCc1scnc1C 17b4cced7a0f86e8feef5a7a1c57aa99 [1,1,0,0,0,0|0,0,1]=3 571 B20R1.65958 CCCCCOCCOCCOCCc1scnc1C 8951ae821753b79cc9440fa491248ea2 [1,1,0,0,0,0|1,0,1]=4 572 B20R1.65958 Cc1ncsc1CCCNCCCCCCCCCO ca79b98a468b3c4c53120b3613c75824 [1,1,0,0,0,0|2,0,0]=4 573 B20R1.65958 Cc1ncsc1CCNCCCCCCCCCCO 98dbbab85efe7e0629dca528d6ae8c1b [1,1,0,0,0,0|1,0,1]=4 574 B20R1.10118 CC(=O)CCCCCCC(=O)NCCc1scnc1C 8f618cde8ddcd46ba7e9ac40cc872ffa [1,1,0,0,0,0|1,0,1]=4 575 B20R1.10118 Cc1ccsc1CCNC(=O)CCCCCCC(C)C 02b8f85266b7621e8406408481ccd0be [1,1,0,0,0,0|2,0,0]=4 576 B20R1.10118 Cc1ccsc1CCNC(=O)CCCCCCC(C)O eae9d5046599c52b01bb27216db7a5bf [1,1,0,0,0,0|2,0,0]=4 577 B20R1.10118 Cc1ncsc1CCNC(=O)CCCCCCC(C)C bf464dd2bcf7c7c32140bbe777781f63 [1,1,0,0,0,0|1,0,0]=3 578 B20R1.10118 Cc1ncsc1CCNC(=O)CCCCCCC(C)O 2da7f4c90ff0373f90be6bddb93e14da [1,1,0,0,0,0|1,0,0]=3 579 B20R1.10118 Cc1ncsc1CCNC(=O)NCCCCCC(C)C 71fdc922242cbf4467402cc672b66e05 [1,1,0,0,0,0|2,0,0]=4 580 B20R1.17303 CCCCCCCC(O)C(=O)NCCc1sccc1C ddc35e4a509f898cce1c62e9c6d22f10 [1,1,0,0,0,0|2,0,0]=4 581 B20R1.17303 CCCCCCCC(O)C(=O)NCCc1scnc1C 0b3a50b19458bca147b2af88b81f8047 [1,1,0,0,0,0|1,0,0]=3 582 B20R1.17303 CCCCCCCN(C)C(=O)NCCc1scnc1C 7a0702d94bf910dc99e5bd6bea6c768a [1,1,0,0,0,0|2,0,0]=4 583 B20R1.49799 CCCC(=O)CCCCC(=O)NCCc1scnc1C 2cd7d226657ba0e3087f1b1b71e9ec9d [1,1,0,0,0,0|1,0,1]=4 584 B20R1.49799 Cc1ncsc1CCNC(=O)CCCCC(O)CCO 2937aa908a00cb1ae45351406e6b6f39 [1,1,0,0,0,0|2,0,0]=4 585 B20R1.49799 Cc1ncsc1CCNC(=O)CCCCC(S)CCS 25deee4211dd534ab45a5e6e3282e233 [1,1,0,0,0,0|2,0,0]=4 586 B20R1.49799 Cc1ncsc1CCNC(=O)CCCC[C@@H](S)CCS 5fa9bb83cbd6b003a2331dd5a1a37aaf [1,1,0,0,0,0|2,0,0]=4 587 B20R1.63321 CCC(C)CCCCCC(=O)NCCc1sccc1C 3dfbce1e2381d7b6f97bd97b72c5e24d [1,1,0,0,0,0|2,0,0]=4 588 B20R1.63321 CCC(C)CCCCCC(=O)NCCc1scnc1C 5a330455e622c1eb93b32ef61468271f [1,1,0,0,0,0|1,0,0]=3 589 B20R1.70758 CCCCC(=O)CCCC(=O)NCCc1scnc1C 5773ec776bba86705a350dd9d134ffee [1,1,0,0,0,0|1,0,1]=4 590 B20R1.70758 CCCCC(C)CCCC(=O)NCCc1sccc1C 93832116970684d9bc05bc38514fc74d [1,1,0,0,0,0|2,0,0]=4 591 B20R1.70758 CCCCC(C)CCCC(=O)NCCc1scnc1C aed90aa67338e0633bc9a59c54569358 [1,1,0,0,0,0|1,0,0]=3 592 B20R1.82069 CCCCCC(=O)CCC(=O)NCCc1scnc1C b3c0174fc25105253137c9bc056eb068 [1,1,0,0,0,0|1,0,1]=4 593 B20R1.82069 CCCCCC(C)CCC(=O)NCCc1sccc1C 40c5cbe66dbacf6c9203a53a2cd8c698 [1,1,0,0,0,0|2,0,0]=4 594 B20R1.82069 CCCCCC(C)CCC(=O)NCCc1scnc1C 9536a9433e5148c108a32f55c0217c06 [1,1,0,0,0,0|1,0,0]=3 595 B20R1.116751 CCCCCCC(C)CC(=O)NCCc1sccc1C 5955a064e9e9a3ac60d6f3444e279593 [1,1,0,0,0,0|2,0,0]=4 596 B20R1.116751 CCCCCCC(C)CC(=O)NCCc1scnc1C 183d8b7578aa8fcb31bcc1d7d2b7c3d3 [1,1,0,0,0,0|1,0,0]=3 597 B20R1.116751 CCCCCCC(C)NC(=O)NCCc1scnc1C 88ab7d8d1ec8105b4dd807ed9d96567a [1,1,0,0,0,0|2,0,0]=4 598 B20R1.116751 CCCCCCC(O)CC(=O)NCCc1sccc1C de50e64066c20a51055107f2e24b0e82 [1,1,0,0,0,0|2,0,0]=4 599 B20R1.116751 CCCCCCC(O)CC(=O)NCCc1scnc1C 67e090f53f5d121bd700289949870b4f [1,1,0,0,0,0|1,0,0]=3 600 B20R1.116751 CCCCCC[C@@H](C)NC(=O)NCCc1scnc1C 78e95fbaa0bc5c28fed29755f11336fc [1,1,0,0,0,0|2,0,0]=4 601 B20R1.116751 CCCCCC[C@H](C)NC(=O)NCCc1scnc1C abf6d190e3333985ed56e90a35badb6e [1,1,0,0,0,0|2,0,0]=4 602 B20R1.439363 CCCCCCCCC(=O)NCCc1sc(nc1C)C 77db7d8d70ddb0ba3107c40eae2e801b [1,1,0,0,0,0|1,0,0]=3 603 B20R1.439363 CSCCCCCCC(=O)NCCc1sc(nc1C)C f799215aaa246923536700c93cc25308 [1,1,0,0,0,0|2,0,0]=4 604 B20R1.439363 Cc1nc(c(s1)CCNC(=O)CCCCCCCF)C 363e8d677bb0cc43a45a624c1d1ad784 [1,1,0,0,0,0|2,0,0]=4 605 B20R1.439363 Cc1nc(c(s1)CCNC(=O)CCCCCCCO)C 35b0a3d29c5d46accf3cf9cd9563379e [1,1,0,0,0,0|2,0,0]=4 606 B20R1.439363 Cc1nc(c(s1)CCNC(=O)CCCCCCCS)C f9f4ebc2d9a627d1e7b37c6fde810733 [1,1,0,0,0,0|2,0,0]=4 607 B20R1.18054 CCCCCCCCCC(=O)NCc1oc(nc1C)C 194b6d1af6e8535b049eb48e94232c81 [0,1,0,0,1,0|1,1,0]=4 608 B20R1.18054 CCCCCCCCCC(=O)NCc1sc(nc1C)Br f164b31d08927baabcc43f899cce9171 [0,1,0,0,1,0|1,0,0]=3 609 B20R1.18054 CCCCCCCCCC(=O)NCc1sc(nc1C)C a56cd8bd313bce8384d4d0fef8c23e5e [0,1,0,0,1,0|1,0,0]=3 610 B20R1.18054 Cc1nc(c(s1)CNC(=O)CCCCCCCCO)C ca5ba63a5f60602d669a64e838b81f85 [0,1,0,0,1,0|2,0,0]=4 611 B20R1.18054 Cc1nc(c(s1)CNC(=O)CCCCCCCCS)C cd010b8c4357674ea9dc7979af32bea2 [0,1,0,0,1,0|2,0,0]=4 612 B20R1.18054 Cc1nc(sc1CNC(=O)CCCCCCCCO)Br 4833e5f79cf1b5717e025b5c0965f7f1 [0,1,0,0,1,0|2,0,0]=4 613 B20R1.18054 Cc1nc(sc1CNC(=O)CCCCCCCCS)Br 1a3b5cc367bc021016ffb57971f0fb78 [0,1,0,0,1,0|2,0,0]=4 614 B20R1.18578 CCCCCCCCCC(=O)N(C)Cc1scnc1C 466bcb4b1841ccdcdc67914539165e46 [0,1,0,0,1,0|1,0,0]=3 615 B20R1.18578 CCCCCCCCCC(=O)N(C)Cc1snnc1C a74ac890cf487998a523225d7517f6e8 [0,1,0,0,1,0|2,0,0]=4 616 B20R1.18578 CCCCCCCCNC(=O)N(C)Cc1scnc1C 0cd66b02dc9038532b19d1a5b1c8b96e [0,1,0,0,1,0|2,0,0]=4 617 B20R1.18578 Cc1ncsc1CN(C)C(=O)CCCCCCCCO 636609e6436cf2cb65a82804231a6ca4 [0,1,0,0,1,0|2,0,0]=4 618 B20R1.18578 Cc1ncsc1CN(C)C(=O)CCCCCCCCS 8757b157e12733127369e9eef14d5833 [0,1,0,0,1,0|2,0,0]=4 619 B20R1.18915 CC(=O)CCCCCCCC(=O)NCc1scnc1C 2328fe484efaca4128bd3cb89889802b [0,1,0,0,1,0|1,0,1]=4 620 B20R1.18915 Cc1ccsc1CCC(=O)NCCCCCCC(C)C bfd20e4298648685a86160ad160fbe77 [0,1,0,0,1,0|2,0,0]=4 621 B20R1.18915 Cc1ncsc1CCC(=O)NCCCCCCC(C)C dd6748078bca090871996cdc114b0b1c [0,1,0,0,1,0|1,0,0]=3 622 B20R1.18915 Cc1ncsc1CCC(=O)NCCCCCCN(C)C 422e5e5beaab3a0fa775dc4563b30e6a [0,1,0,0,1,0|2,0,0]=4 623 B20R1.18915 Cc1ncsc1CCC(=O)NCCCCSCC(C)C 269499bbb4ccf47cc091e570d9a7c80b [0,1,0,0,1,0|2,0,0]=4 624 B20R1.18915 Cc1ncsc1CNC(=O)NCCCCCCC(C)C 13e661094e8246707136d7c9650d8545 [0,1,0,0,1,0|2,0,0]=4 625 B20R1.57736 CCC(C)CCCCCCC(=O)NCc1scnc1Br c064572fd19891b28ddd8aa136a616d7 [0,1,0,0,1,0|2,0,0]=4 626 B20R1.57736 CCC(C)CCCCCCC(=O)NCc1scnc1C 1decce16b8c991dcf2a0698d01e359a0 [0,1,0,0,1,0|1,0,0]=3 627 B20R1.57736 CCC(C)CCCCCCC(=O)NCc1snnc1C 7721cd770ee1a6c331514aebb67ff615 [0,1,0,0,1,0|2,0,0]=4 628 B20R1.59020 CCCCCCCC(O)CC(=O)NCc1scnc1C 2d3e0c017bbcc17ed5d0a088f4be67db [0,1,0,0,1,0|1,0,0]=3 629 B20R1.59020 CCCCCCCC(O)CC(=O)NCc1snnc1C 038e96553000494bd8c7011b52850316 [0,1,0,0,1,0|2,0,0]=4 630 B20R1.59020 CCCCCCC[C@@H](O)CC(=O)NCc1scnc1C d005f752bc16d6701a90b6e262718a20 [0,1,0,0,1,0|1,0,0]=3 631 B20R1.59020 CCCCCCC[C@@H](O)CC(=O)NCc1snnc1C c39d88856e2cb03b4139d6856eba828e [0,1,0,0,1,0|2,0,0]=4 632 B20R1.59020 CCCCCCC[C@H](C)NC(=O)CCc1sccc1C a70e563b1b2ef83b402cc18d4a71e033 [0,1,0,0,1,0|2,0,0]=4 633 B20R1.59020 CCCCCCC[C@H](C)NC(=O)CCc1scnc1C 15b18c519ee92c31f1c0737c997e7e7e [0,1,0,0,1,0|1,0,0]=3 634 B20R1.59020 CCCCCCC[C@H](C)NC(=O)NCc1scnc1C aa3100162cfa3b9ff8a297c3412b78ee [0,1,0,0,1,0|2,0,0]=4 635 B20R1.67917 CCCCCCCCCC(=O)NCc1sccc1OC 331acc0b8d5f860ac88bace53182cf4c [0,1,0,0,1,0|2,0,0]=4 636 B20R1.68095 CCCCCCC(=O)CCC(=O)NCc1scnc1C 28233da02edfe082a94e560c5304f26d [0,1,0,0,1,0|1,0,1]=4 637 B20R1.69877 CCCCC(=O)CCCCC(=O)NCc1scnc1C 40be61db8001074d57f7dc2ceb0dad0d [0,1,0,0,1,0|1,0,1]=4 638 B20R1.69877 CCCCN(C)CCCNC(=O)CCc1scnc1C 0efd181af291ae76d40010344155b525 [0,1,0,0,1,0|2,0,0]=4 639 B20R1.81843 CCCCCC(=O)CCCC(=O)NCc1scnc1C 77a62ecd500031353d29a4e74abbe9ae [0,1,0,0,1,0|1,0,1]=4 640 B20R1.81843 CCCCCC(O)CCCC(=O)NCc1scnc1Br edc1782f26471157519ddc22fb6705b7 [0,1,0,0,1,0|2,0,0]=4 641 B20R1.81843 CCCCCC(O)CCCC(=O)NCc1scnc1C 5639059444b02d589e629e3255cd4567 [0,1,0,0,1,0|1,0,0]=3 642 B20R1.81843 CCCCCC(O)CCCC(=O)NCc1snnc1C 2210f5197ea42cdf8ddb83adf98ea38a [0,1,0,0,1,0|2,0,0]=4 643 B22R1.21680 CC(=O)CCCCCCCC(=O)NCCCc1scnc1C caca309aca0ece45c0ec6fdbe94b919c [0,1,0,0,0,1|1,0,1]=4 644 B22R1.21680 Cc1ncsc1CCCNC(=O)NCCCCCCC(C)C 8ca4105ce6fa5540296bc5010bbe332d [0,1,0,0,0,1|2,0,0]=4 645 B22R1.42489 CCCCCCCCCC(=O)OCOCc1ccnn1CC 1fde2c6292dcb26ec4e0f7225fc419f3 [0,1,0,0,0,1|2,0,0]=4 646 B22R1.42489 CCCCCCCCCC(=O)OCOCc1ncnn1CC 5f9f64e0b7227dcdecbea1cc31fe6fdd [0,1,0,0,0,1|2,0,0]=4 647 B22R1.104473 CCCCCC(=O)CCCC(=O)NCCCc1scnc1C 5880ace6cb8c41e6bc547b6075e05aff [0,1,0,0,0,1|1,0,1]=4 648 B22R1.104473 CCCCCC(O)CCCC(=O)NCCCc1scnc1C eb9e3d4832c2277dc2a6e71a2575f693 [0,1,0,0,0,1|1,0,0]=3 649 B22R1.119490 C#CCCCCCCCCC(=O)NCCCc1scnc1C 2353775ef747d866c16a9d07156150ed [0,1,0,0,0,1|1,0,1]=4 650 B22R1.119490 C=CCCCCCCCCC(=O)NCCCc1scnc1C a439ddf920aeb4495c1b1006cf95013a [0,1,0,0,0,1|1,0,1]=4 651 B22R1.119490 CCCCCCCC/C=C/C(=O)NCCCc1scnc1C 045f1224ed2c61bf8e32a807143f2d99 [0,1,0,0,0,1|1,0,1]=4 652 B22R1.119490 CCCCCCCCC=CC(=O)NCCCc1scnc1C d3b8e17b18ba06dea8345cb7bbdca3f8 [0,1,0,0,0,1|1,0,1]=4 653 B22R1.119490 CCCCCCCCCCC(=O)NCCCc1scnc1C 95ece35dc84a22758afc3516be18f620 [0,1,0,0,0,1|1,0,0]=3 654 B22R1.119490 CCCCCCCCCNC(=O)NCCCc1scnc1C 6ab17b7a33c4f1b6f92db07ab85af872 [0,1,0,0,0,1|1,0,0]=3 655 B22R1.119490 CCCCCCCCCNC(=S)NCCCc1scnc1C a95c64db074632435bac018b87358bf5 [0,1,0,0,0,1|1,1,0]=4 656 B22R1.119490 CCCCCCCCCOC(=O)CCCNc1scnc1C ffe2bc2ba6c0f3c2897c38a51611df9b [0,1,0,0,0,1|1,0,0]=3 657 B22R1.119490 CCCCCCCCOCC(=O)NCCCc1scnc1C e145425907b545d0044f2ef484c82435 [0,1,0,0,0,1|1,0,0]=3 658 B22R1.119490 COCCOCCCCCC(=O)NCCCc1scnc1C 9191a6e3466977cfd68a3c028d4fa3f4 [0,1,0,0,0,1|2,0,0]=4 659 B22R1.119490 Cc1ncsc1CCCNC(=O)CCCCCCCCC=O bdb93f9e2946e30d222576c864dbe60e [0,1,0,0,0,1|1,0,1]=4 660 B22R1.119490 Cc1ncsc1CCCNC(=O)CCCCCCCCCF ce792a2f733c2c8ebd9e9b65401fea0a [0,1,0,0,0,1|1,0,0]=3 661 B22R1.119490 Cc1ncsc1CCCNC(=O)CCCCCCCCCO 6a22194c09b25d5f391f692641436569 [0,1,0,0,0,1|1,0,0]=3 662 B22R1.119490 Cc1ncsc1CCCNC(=O)NCCCCCCCCN f8b0f981544c87a4ac4824ef0ac28430 [0,1,0,0,0,1|2,0,0]=4 663 B22R1.119490 Cc1ncsc1CCCNC(=O)NCCCCCCCCO 82d81b31af1195bff073e7453e51f161 [0,1,0,0,0,1|2,0,0]=4 664 B22R1.160114 CCCCC(=O)CCCCC(=O)NCCCc1scnc1C bfcb86ab7c8501c94f540b0fec5da0cd [0,1,0,0,0,1|1,0,1]=4 665 B22R1.274243 CCCCCCCCC(O)C(=O)NCCCc1scnc1C b304439504ca29bb95a442926b051ff5 [0,1,0,0,0,1|1,0,0]=3 666 B22R1.274243 CCCCCCCCN(C)C(=O)NCCCc1scnc1C 61c6346a47284ea4802fa2c2bddc8054 [0,1,0,0,0,1|2,0,0]=4 667 B22R1.274243 CCCCCCCOC(C)C(=O)NCCCc1scnc1C 9be6015dbcb626d9243fdb2060c28cff [0,1,0,0,0,1|2,0,0]=4 668 B22R1.327446 CCCCCCCCNC(=O)C(=O)NCCc1scnc1C 0b316efcb1972263e71b1c1490770a2c [0,1,0,0,0,1|2,0,0]=4 669 B22R1.328386 CCCCCCCCCC(=O)NCC(=O)Nc1scnc1C 53ff529d87c8ced9fed091c76492aebe [0,1,0,0,0,1|1,0,1]=4 670 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1ccnn1C 6dd5a815fb4d5f2266fd4342381c514d [0,1,0,0,0,1|2,0,0]=4 671 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1ccoc1C d1b2b8b10ec01c7ab3a5c40141f88577 [0,1,0,0,0,1|2,0,0]=4 672 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1nonc1C c8b5d49f95d9e5cbc4e87c51faacd578 [0,1,0,0,0,1|2,0,0]=4 673 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1scnc1C 0915d6ad8f6c6e5afd836de1b97a5f34 [0,1,0,0,0,1|0,0,0]=2 674 B22R1.328386 CCCCCCCCCC(=O)OCN(C)Cc1snnc1C a7f51056cae52a2ea7d9f1af9e01b0d8 [0,1,0,0,0,1|1,0,0]=3 675 B22R1.915756 CCCCCCC(=O)CCC(=O)NCCCc1scnc1C 7761d830d5e74e6fec3b97e2c9c1fb15 [0,1,0,0,0,1|1,0,1]=4 676 B22R1.929724 CCCCCCCC(O)CC(=O)NCCCc1scnc1C 7206dc4be358d56ee40fb777ff3a0605 [0,1,0,0,0,1|1,0,0]=3 677 B22R1.929724 CCCCCCC[C@@H](O)CC(=O)NCCCc1scnc1C 2bb238463574d637ecbaeaaf71041181 [0,1,0,0,0,1|1,0,0]=3 678 B22R1.929724 CCCCCCC[C@H](C)NC(=O)NCCCc1scnc1C 084a9902586da08e9e40962bce4db036 [0,1,0,0,0,1|2,0,0]=4 679 B22R1.950820 CCCCCCCCCC(=O)OCOCc1ncn(c1C)C 5c5e307fac905ed2b0a4721422de241b [0,1,0,0,0,1|1,0,1]=4 680 B22R1.950820 CCCCCCCCCC(=O)OCOCc1scc(c1Cl)C 9fd05a4ac78a4383b149bdc522b46502 [0,1,0,0,0,1|2,0,0]=4 681 B22R1.950895 CCCCCCCCCC(=O)OCOCc1cc(nn1C)C 23236c4cf3105eb3dd577d644323fb26 [0,1,0,0,0,1|2,0,0]=4 682 B22R1.950895 CCCCCCCCCC(=O)OCOCc1cc(oc1C)C b265d29103de5ec1ec6dd5620e0d1488 [0,1,0,0,0,1|2,0,0]=4 683 B22R1.950895 CCCCCCCCCC(=O)OCOCc1cn(nc1C)C d2f2601e9cca797ba51767215145994e [0,1,0,0,0,1|2,0,0]=4 684 B22R1.950895 CCCCCCCCCC(=O)OCOCc1nc(oc1C)Br 4f2760bebf66fc9f9085809241c9f834 [0,1,0,0,0,1|2,0,0]=4 685 B22R1.950895 CCCCCCCCCC(=O)OCOCc1nc(oc1C)C 7ee73c1fea7823598445b106e4fa56e6 [0,1,0,0,0,1|2,0,0]=4 686 B22R1.950895 CCCCCCCCCC(=O)OCOCc1nc(sc1C)C a161c703dc1560f7b987182bcb6f8977 [0,1,0,0,0,1|2,0,0]=4 687 B22R1.950895 CCCCCCCCCC(=O)OCOCc1oc(=O)oc1C 256d914b10062c6a23daee38719314d8 [0,1,0,0,0,1|1,1,0]=4 688 B22R1.950895 CCCCCCCCCC(=O)OCOCc1oc(nc1C)C 594ed40aebb8d2c91fdddb213510c3a4 [0,1,0,0,0,1|0,1,0]=3 689 B22R1.950968 CCCCCCCCCC(=O)OCOC(C)c1c[nH]nc1C c32dc6636064b0e14966e1b846df7a23 [0,1,0,0,0,1|2,0,0]=4 690 B22R1.1658992 CCCCCCCCCC(=O)OCOCc1c(cnn1C)C 5d74c7b307285133750664ba895cb785 [0,1,0,0,0,1|2,0,0]=4 691 B22R1.1658992 CCCCCCCCCC(=O)OCOCc1c(cnn1C)I a78319b5b0733c6b7e2411ad0a9101f0 [0,1,0,0,0,1|2,0,0]=4 692 B22R1.1658992 CCCCCCCCCC(=O)OCOCc1c(n[nH]c1C)C 7c9570237c4feb96d11a4dd378345bdb [0,1,0,0,0,1|2,0,0]=4 693 B22R1.1910504 CCC(C)CCCCCCC(=O)NCCCc1scnc1C fcc73e5979e042328350028c6796793f [0,1,0,0,0,1|1,0,0]=3 694 B22R1.42492 CCCCCCCCCC(=O)OCNc1cc(nc(c1)Br)C 9515fb4e52b6cf35e0e496f9ffb13cb2 [0,1,0,0,0,1|2,0,0]=4 695 B22R1.42492 CCCCCCCCCC(=O)OCNc1cc(nc(c1)C)C 29f403f73b1b4d2ee7162bc6f7be5ac2 [0,1,0,0,0,1|2,0,0]=4 696 B22R1.42492 CCCCCCCCCC(=O)OCNc1cc(nc(c1)Cl)C 464dd8cc8b7a1c7a51507075a3b1ae87 [0,1,0,0,0,1|2,0,0]=4 697 B22R1.42492 CCCCCCCCCC(=O)OCNc1cc(nc(c1)F)C c46322e5e8c38ef006aaf7f4064bd4e6 [0,1,0,0,0,1|2,0,0]=4 698 B22R1.42492 CCCCCCCCCC(=O)OCOc1cc(nc(c1)Cl)C e57ae53731017e043cab9937736c136d [0,1,0,0,0,1|2,0,0]=4 699 B22R1.42492 CCCCCCCCCC(=O)OCOc1cc(nc(n1)Cl)C e9a06d6ca51734b3fb2e4c7612e9964b [0,1,0,0,0,1|2,0,0]=4 700 B22R1.69445 CCCCCCCCCC(=O)OCOc1ncnc(c1Cl)C 5d98e93e5f8e67e86031d82d35cc7544 [0,1,0,0,0,1|2,0,0]=4 701 B22R1.70894 CCCCCCCC(O)CC(=O)NCCc1ccnc(c1)C 8a8df5a46aec06cbe186f7907bff566d [0,1,0,0,0,1|2,0,0]=4 702 B22R1.70894 CCCCCCC[C@@H](O)CC(=O)NCCc1ccnc(c1)C a6f47ab52cc35abadd7a413d8fccd06e [0,1,0,0,0,1|2,0,0]=4 703 B22R1.75489 CCC(C)CCCCCCC(=O)NCCc1ccnc(c1)C 2abe6725373930016027aa1426661c87 [0,1,0,0,0,1|2,0,0]=4 704 B22R1.78800 CCCCCCCCCCC(=O)NCCc1ccnc(c1)C c0705d914470f8a01e34e0458803c595 [0,1,0,0,0,1|2,0,0]=4 705 B22R1.78800 CCCCCCCCCNC(=O)NCCc1ccnc(c1)C 3109376868bc221821d48d358f392ef1 [0,1,0,0,0,1|2,0,0]=4 706 B22R1.78800 CCCCCCCCOCC(=O)NCCc1ccnc(c1)C 63707f0adde85b6bea57553d5aa51f04 [0,1,0,0,0,1|2,0,0]=4 707 B22R1.78800 Cc1cc(ccn1)CCNC(=O)CCCCCCCCCF c0b443739d2b57bf57569acbfaaef977 [0,1,0,0,0,1|2,0,0]=4 708 B22R1.78800 Cc1cc(ccn1)CCNC(=O)CCCCCCCCCO 5cad646f33b04ef70ef4754efb4e08fb [0,1,0,0,0,1|2,0,0]=4 709 B22R1.82430 CCCCCCCCC(O)C(=O)NCCc1ccnc(c1)C ac0c7a886c250ac30eb740971683b607 [0,1,0,0,0,1|2,0,0]=4 710 B22R1.105900 CCCCCC(O)CCCC(=O)NCCc1ccnc(c1)C e90082d2d06fdd6afcb4eed2555e8abd [0,1,0,0,0,1|2,0,0]=4 711 B22R1.951109 CCCCCCCCCC(=O)OCNc1cc(ncn1)CC 3950e33d9d22741684b3cd629d677ccd [0,1,0,0,0,1|2,0,0]=4 712 B22R1.951109 CCCCCCCCCC(=O)OCNc1ccnc(c1)CC e7e567e9bd26177a4112c3abb3f3b748 [0,1,0,0,0,1|2,0,0]=4 713 B22R1.951109 CCCCCCCCCC(=O)OCNc1ccnc(c1)CO ea40508fba1221779031bc50c4c10560 [0,1,0,0,0,1|2,0,0]=4 714 B22R1.951109 CCCCCCCCCC(=O)OCNc1ccnc(c1)SC 2e010f356d765fddc6240a2d3bb847f9 [0,1,0,0,0,1|2,0,0]=4 715 B22R1.951109 CCCCCCCCCC(=O)OCOc1cc(ncn1)CC 3fec1cf203a9dae731cb99421ba3b897 [0,1,0,0,0,1|2,0,0]=4 716 B22R1.951109 CCCCCCCCCC(=O)OCOc1ccnc(c1)OC 2e7f78cbe0376458037074b1dab30d48 [0,1,0,0,0,1|2,0,0]=4 717 B22R1.951109 CCCCCCCCCC(=O)OCOc1ccnc(c1)SC 62477dcf3a0f1f790a8bef6f702bfdef [0,1,0,0,0,1|2,0,0]=4 718 B22R1.951109 CCCCCCCCCC(=O)OCOc1ccnc(n1)CC e5cf380238d6f2de273a79b8d1f604be [0,1,0,0,0,1|2,0,0]=4 719 B22R1.1399596 CCCCCCCCCC(=O)OCOc1nc(ncc1F)C 08981e83427ddd2f9b7db01d7d2a61c4 [0,1,0,0,0,1|2,0,0]=4 720 B22R1.42551 CCCCCCCCCC(=O)NCCc1cccnc1OC 5fa5ddc1aca3e03f3481bce13259b60e [0,1,0,0,0,1|2,0,0]=4 721 B22R1.42551 CCCCCCCCCC(=O)OCOc1cccnc1CC e16e452922c00ad2ac8c73af6d97ef92 [0,1,0,0,0,1|2,0,0]=4 722 B22R1.328377 CCCCCCCCCC(=O)OCN(C)c1cccnc1C 744ef42138dc7531fb22f04f31b442ef [0,1,0,0,0,1|2,0,0]=4 723 B22R1.328377 CCCCCCCCCC(=O)OCN(C)c1nccnc1C 46379ed92de1aab20e5396b3b647125d [0,1,0,0,0,1|2,0,0]=4 724 B22R1.14153819 CCCCCCCCCC(=O)OCOc1c(ccnc1C)C 0ffcd26603378d225db044ed8bf575f1 [0,1,0,0,0,1|2,0,0]=4 725 B22R1.14153819 CCCCCCCCCC(=O)OCOc1c(cncc1Br)C cb306afbe57082185877bc27c0a5c5d5 [0,1,0,0,0,1|2,0,0]=4 726 B22R1.14153819 CCCCCCCCCC(=O)OCOc1c(ncnc1C)C 01de7c15308d77e465e1edbc65189ae9 [0,1,0,0,0,1|2,0,0]=4 727 B22R1.389701 Cc1ccsc1CCNC(=O)CCCC(C)CCCC(C)C 277ca815c16877a1348208fb174aaae4 [0,2,0,0,0,0|2,0,0]=4 728 B22R1.389701 Cc1ncsc1CCNC(=O)CCCC(C)CCCC(C)C 6f73e3ded711fa2b5153d7be1bcd3b34 [0,2,0,0,0,0|1,0,0]=3 729 B22R1.389701 Cc1ncsc1CCNC(=O)NCCC(C)CCCC(C)C 4e3cd69f0d3fff0e39da0c709aa6f462 [0,2,0,0,0,0|2,0,0]=4 730 B22R1.1910669 COC(=O)CCCCCCCC(=O)NCCc1scnc1C 796952e00945c05550638f06eb4ddda4 [0,2,0,0,0,0|1,0,1]=4 731 B22R1.5990427 CC(=O)CCCCCCCC(=O)NCCc1sc(nc1C)C 394c68dfd9ba6936aed4a30d3c4213ce [0,2,0,0,0,0|1,0,1]=4 732 B22R1.5990427 Cc1nc(c(s1)CCNC(=O)NCCCCCCC(C)C)C 9982b7b7554c9ff10902666bd5fa9c2b [0,2,0,0,0,0|2,0,0]=4 733 B22R1.21678 CC(=O)CCCCCCCCC(=O)NCCc1sccc1C 05fa6fbee34a9f03725e22b51b0434bd [0,2,0,0,0,0|2,0,0]=4 734 B22R1.21678 CC(=O)CCCCCCCCC(=O)NCCc1scnc1C 72aeb09c772b9d4bdf329ae33f638c53 [0,2,0,0,0,0|1,0,0]=3 735 B22R1.21678 Cc1ccsc1CCNC(=O)CCCCCCCCC(C)C c4d9d03b58e6380fe663ca4d90576be3 [0,2,0,0,0,0|2,0,0]=4 736 B22R1.21678 Cc1ncsc1CCNC(=O)CCCCCCCCC(=O)N 7032ff5eef969beca1f365b78d2d98c7 [0,2,0,0,0,0|1,0,1]=4 737 B22R1.21678 Cc1ncsc1CCNC(=O)CCCCCCCCC(C)C bb64aa7097ac620e43a86a2a5edbf9f2 [0,2,0,0,0,0|1,0,0]=3 738 B22R1.21678 Cc1ncsc1CCNC(=O)NCCCCCCCN(C)C 90722d9cde1e20f96532b4dd8ac38383 [0,2,0,0,0,0|2,0,0]=4 739 B22R1.119719 C#CCCCCCCCCCC(=O)NCCc1sccc1C f1af20bde311d53c72f991f6b0801dd2 [0,2,0,0,0,0|2,0,0]=4 740 B22R1.119719 C#CCCCCCCCCCC(=O)NCCc1scnc1C 03ab5cda5a0c7e56b1968be10aeeee46 [0,2,0,0,0,0|1,0,0]=3 741 B22R1.119719 C#CCCCCCCCCNC(=O)NCCc1scnc1C 0bcc2c4b3f7030aafb6db9bd0ddde933 [0,2,0,0,0,0|1,0,1]=4 742 B22R1.119719 C=CCCCCCCCCCC(=O)NCCc1sccc1C e67bbbfe34b7a6b1b87b6819f1bdb468 [0,2,0,0,0,0|2,0,0]=4 743 B22R1.119719 C=CCCCCCCCCCC(=O)NCCc1scnc1C 591647d507e99bdaeaed63e4c835d08c [0,2,0,0,0,0|1,0,0]=3 744 B22R1.119719 CCCCCC/C=C\CCCC(=O)NCCc1sccc1C e2ba388ac8d5c1992bc3b6f6120c235c [0,2,0,0,0,0|2,0,0]=4 745 B22R1.119719 CCCCCC/C=C\CCCC(=O)NCCc1scnc1C ee13fac3e36f87c37fc5952596ad5a58 [0,2,0,0,0,0|1,0,0]=3 746 B22R1.119719 CCCCCCC=CCCCC(=O)NCCc1sccc1C 74a7dade8e82f461a48a32eb6eea10af [0,2,0,0,0,0|2,0,0]=4 747 B22R1.119719 CCCCCCC=CCCCC(=O)NCCc1scnc1C fb1efaed23994e7c46e106ab0b4af25b [0,2,0,0,0,0|1,0,0]=3 748 B22R1.119719 CCCCCCCCC/C=C/C(=O)NCCc1sccc1C 743d42a35182275de5fe995799a4565f [0,2,0,0,0,0|2,0,0]=4 749 B22R1.119719 CCCCCCCCC/C=C/C(=O)NCCc1scnc1C 3cf4e3dce298a136f442ac033cfc05e9 [0,2,0,0,0,0|1,0,0]=3 750 B22R1.119719 CCCCCCCCC/C=C\C(=O)NCCc1sccc1C 3e31ecc720d84c716b9215b94a8cbb99 [0,2,0,0,0,0|2,0,0]=4 751 B22R1.119719 CCCCCCCCC/C=C\C(=O)NCCc1scnc1C b4ac5df9d6d423685c0d0f29c66c339d [0,2,0,0,0,0|1,0,0]=3 752 B22R1.119719 CCCCCCCCCCCC(=O)NCCc1sccc1C 6d26ee36f6ab1acc83169cb2e4874a86 [0,2,0,0,0,0|2,0,0]=4 753 B22R1.119719 CCCCCCCCCCCC(=O)NCCc1scnc1C f433575822f0407247ea93fbb685ea1f [0,2,0,0,0,0|1,0,0]=3 754 B22R1.119719 CCCCCCCCCCNC(=S)NCCc1scnc1C f96ec4fefe54996154297b446d6cda96 [0,2,0,0,0,0|1,1,0]=4 755 B22R1.119719 CCCCCCCCCCOC(=O)CNCc1scnc1C bf7941d537de6ca0aa1910f7197ac120 [0,2,0,0,0,0|2,0,0]=4 756 B22R1.119719 CCCCCCCCCCOC(=O)COCc1scnc1C 6a0132e507f5ea78fba15421814eb1e7 [0,2,0,0,0,0|2,0,0]=4 757 B22R1.119719 CCCCOCCOCCNC(=O)NCCc1scnc1C 95c97e1aaeef5e4c1404211de5699658 [0,2,0,0,0,0|2,0,0]=4 758 B22R1.119719 Cc1ccsc1CCNC(=O)CCCCCCCCCCO 055b3c4f457db30c851a304a0f927caf [0,2,0,0,0,0|2,0,0]=4 759 B22R1.119719 Cc1ccsc1CCNC(=O)CCCCCCCCCCS 532233bba46ab1ba7611eb52539dd8f7 [0,2,0,0,0,0|2,0,0]=4 760 B22R1.119719 Cc1ccsc1CCNC(=O)NCCCCCCCCCN ccd5e07811fc70ed4ec3a5adb6487646 [0,2,0,0,0,0|2,0,0]=4 761 B22R1.119719 Cc1ccsc1CCNC(=O)NCCCCCCCCCO 26e512412e8bad8124464eeeeb189474 [0,2,0,0,0,0|2,0,0]=4 762 B22R1.119719 Cc1ncsc1CCNC(=O)CCCCCCCCCCO 9bc0f63827a5c3c1e3366575a793d51b [0,2,0,0,0,0|1,0,0]=3 763 B22R1.119719 Cc1ncsc1CCNC(=O)CCCCCCCCCCS e7d67fc99cb34cab0703ffdd9795c117 [0,2,0,0,0,0|1,0,0]=3 764 B22R1.119719 Cc1ncsc1CCNC(=O)NCCCCCCCCCN cc898bb12a9f062e6491983f47d52884 [0,2,0,0,0,0|1,0,0]=3 765 B22R1.119719 Cc1ncsc1CCNC(=O)NCCCCCCCCCO 22e472e84b9a0ee37dc81bb23520bbfd [0,2,0,0,0,0|1,0,0]=3 766 B22R1.119719 Cc1ncsc1CCNC(=S)NCCCCCCCCCN 30ac0280bbeda20ff6d17219b6f0035a [0,2,0,0,0,0|1,1,0]=4 767 B22R1.119719 Cc1ncsc1CCNC(=S)NCCCCCCCCCO 0172f06fbddc0e24ac3339b5eaa4fc46 [0,2,0,0,0,0|1,1,0]=4 768 B22R1.156991 CCOC(=O)CCCCCCC(=O)NCCc1scnc1C 82e05cfdd5717b8d0849976168b26921 [0,2,0,0,0,0|1,0,1]=4 769 B22R1.254742 CCCCCCC(=O)CCCC(=O)NCCc1sccc1C e1645cb8626519f8ac983ceabcdf4f97 [0,2,0,0,0,0|2,0,0]=4 770 B22R1.254742 CCCCCCC(=O)CCCC(=O)NCCc1scnc1C cf07bed54e050af62d3f23938c4e4401 [0,2,0,0,0,0|1,0,0]=3 771 B22R1.254742 CCCCCCC(O)CCCC(=O)NCCc1sccc1C 4efa1cf9b25c7d398c5c24394d859396 [0,2,0,0,0,0|2,0,0]=4 772 B22R1.254742 CCCCCCC(O)CCCC(=O)NCCc1scnc1C 8336b2537b5f8ab4a624ae109e6cbf3d [0,2,0,0,0,0|1,0,0]=3 773 B22R1.273945 CCCCCCCCC(C)NC(=O)NCCc1scnc1C ed906c135f8bc9e7130bc5725d66cbc0 [0,2,0,0,0,0|1,0,0]=3 774 B22R1.273945 CCCCCCCCC(C)NC(=S)NCCc1scnc1C 42a26d18b2ff803e3772f1da87b3f700 [0,2,0,0,0,0|1,1,0]=4 775 B22R1.273945 CCCCCCCCC(O)CC(=O)NCCc1sccc1C 658d12064c8bc85f6941cf8473014355 [0,2,0,0,0,0|2,0,0]=4 776 B22R1.273945 CCCCCCCCC(O)CC(=O)NCCc1scnc1C 03eedb357d7eda971513cf256af54a12 [0,2,0,0,0,0|1,0,0]=3 777 B22R1.391754 CCCCCCCC(=O)CCC(=O)NCCc1sccc1C eb7bb67b5a3466b531eba65a470b47ce [0,2,0,0,0,0|2,0,0]=4 778 B22R1.391754 CCCCCCCC(=O)CCC(=O)NCCc1scnc1C 6bf63a49f1f34000ba0dfea8c0365515 [0,2,0,0,0,0|1,0,0]=3 779 B22R1.391754 CCCCCCCC(=O)NCC(=O)NCCc1scnc1C 2dc78526b012f38ba2b7e5cc30a8851b [0,2,0,0,0,0|1,0,1]=4 780 B22R1.1618548 C#CCCCCCCCCC(=O)NCCc1sc(nc1C)C 95d47e0d5b54bd1c678066a362a95bd0 [0,2,0,0,0,0|1,0,1]=4 781 B22R1.1618548 C=CCCCCCCCCC(=O)NCCc1sc(nc1C)C c8fdb61865b93e6a412b49fb51eb32b8 [0,2,0,0,0,0|1,0,1]=4 782 B22R1.1618548 CCCCCCCC/C=C/C(=O)NCCc1sc(nc1C)C fee7063809ecca1d94763fb04052a472 [0,2,0,0,0,0|1,0,1]=4 783 B22R1.1618548 CCCCCCCCC=CC(=O)NCCc1sc(nc1C)C 4fbafd824d6cf2dbe6e46129dc0f2017 [0,2,0,0,0,0|1,0,1]=4 784 B22R1.1618548 CCCCCCCCCCC(=O)NCCc1sc(nc1C)C 4eeed90e27205c92cb64d482052dc134 [0,2,0,0,0,0|1,0,0]=3 785 B22R1.1618548 CCCCCCCCCNC(=S)NCCc1sc(nc1C)C c8d2b0a6a80f00a8821c87487a835796 [0,2,0,0,0,0|1,1,0]=4 786 B22R1.1618548 CCCCCCCCOCC(=O)NCCc1sc(nc1C)C e5b71d5c3d471b81dbd5ba40aca5197c [0,2,0,0,0,0|1,0,0]=3 787 B22R1.1618548 COCCOCCCCCC(=O)NCCc1sc(nc1C)C 67c2c1a178a9a7d1bd480b030137b6b5 [0,2,0,0,0,0|2,0,0]=4 788 B22R1.1618548 Cc1nc(c(s1)CCNC(=O)CCCCCCCCC=O)C 3a007517d766547341c7096f00d9ab14 [0,2,0,0,0,0|1,0,1]=4 789 B22R1.1618548 Cc1nc(c(s1)CCNC(=O)CCCCCCCCCF)C 19f385fb4f15a51b86ace195693f73b8 [0,2,0,0,0,0|1,0,0]=3 790 B22R1.1618548 Cc1nc(c(s1)CCNC(=O)CCCCCCCCCO)C 78d23e77dbfb1f31557b40eda568ce0f [0,2,0,0,0,0|1,0,0]=3 791 B22R1.1618548 Cc1nc(c(s1)CCNC(=O)NCCCCCCCCN)C 3310e69299d3eeb15d0dbf1df4d7e5bd [0,2,0,0,0,0|2,0,0]=4 792 B22R1.1495552 CCC(C)CCCCCCC(=O)NCCc1sc(nc1C)C 9a27007aeb704f070782ea712eb9b8b0 [0,2,0,0,0,0|1,0,0]=3 793 B22R1.1690645 CCCCC(=O)CCCCC(=O)NCCc1sc(nc1C)C 2c5fbf7da63809aafdde0997ab7bd106 [0,2,0,0,0,0|1,0,1]=4 794 B22R1.1965053 CCCCCC(=O)CCCC(=O)NCCc1sc(nc1C)C afc8d8fc8a5db6fe0d6fecf4ff59e3b2 [0,2,0,0,0,0|1,0,1]=4 795 B22R1.1965053 CCCCCC(O)CCCC(=O)NCCc1sc(nc1C)C 20ba8536882910a9873222d2bf41c152 [0,2,0,0,0,0|1,0,0]=3 796 B22R1.1665116 CCCCCCCCC(O)C(=O)NCCc1sc(nc1C)C 481f326ef319721ecafc0503cced900a [0,2,0,0,0,0|1,0,0]=3 797 B22R1.1665116 CCCCCCCCN(C)C(=O)NCCc1sc(nc1C)C c567bea744733f803bcfd99b4d0b8270 [0,2,0,0,0,0|2,0,0]=4 798 B22R1.1665116 CCCCCCCOC(C)C(=O)NCCc1sc(nc1C)C 0927850d9f226d2dc3cfdecea280a853 [0,2,0,0,0,0|2,0,0]=4 799 B22R1.1662475 CCCCCCC(=O)CCC(=O)NCCc1sc(nc1C)C 77b6f4ce667b9bd0fd564e54d28cef5b [0,2,0,0,0,0|1,0,1]=4 800 B22R1.1399226 CCCCCCCCC[C@H](NCCc1scnc1C)C(=O)O b6e7c6e1c50e65b407f83b606c910f4e [0,2,0,0,0,0|1,0,1]=4 801 B22R1.858015 CCCCCCCC(CC)CC(=O)NCCc1sccc1C 0444b7c53c59729c1f9c7e6bb828ff59 [0,2,0,0,0,0|2,0,0]=4 802 B22R1.858015 CCCCCCCC(CC)CC(=O)NCCc1scnc1C 4e6ace96657a90f6a79889177ed655b0 [0,2,0,0,0,0|1,0,0]=3 803 B22R1.1416481 CCCCCCCC(O)CC(=O)NCCc1sc(nc1C)C bbcfae02649c09cc38b0fe65d7dbbbc5 [0,2,0,0,0,0|1,0,0]=3 804 B22R1.1416481 CCCCCCC[C@@H](O)CC(=O)NCCc1sc(nc1C)C 07c2a5675b06216b76223bb5bce40547 [0,2,0,0,0,0|1,0,0]=3 805 B20R2.174738 O=C(CCCC1CCCCC1)NCCc2cccs2 ed35ccea1652bbc6bd49430ea48daa56 [1,0,0,1,0,0|2,0,0]=4 806 B20R2.174738 O=C(CCCC1CCCCC1)NCCc2nncs2 868e5e80c2d3a8e03874fa5633778741 [1,0,0,1,0,0|2,0,0]=4 807 B20R2.4856 Cc1ncsc1CCCNCCCC2CCCCC2 7bc53ba115c248249f697632a05f91f8 [1,0,0,1,0,0|2,0,0]=4 808 B20R2.4856 Cc1ncsc1CCCOCCCC2CCCCC2 26afa007a1f48645e8c842be6e9890f9 [1,0,0,1,0,0|2,0,0]=4 809 B20R2.4856 Cc1ncsc1CCNCCCCC2CCCCC2 6159465567b7d173aa32be74b5195c37 [1,0,0,1,0,0|1,0,1]=4 810 B20R2.4856 Cc1ncsc1CCOCCCCC2CCCCC2 cf6d2861f940cb7fdb7a7c09ed659b08 [1,0,0,1,0,0|0,0,1]=3 811 B20R2.4856 Cc1ncsc1CCOCCCCN2CCCCC2 ae2b00471ff28824a9fd239a4032eae6 [1,0,0,1,0,0|1,0,1]=4 812 B20R2.4856 Cc1ncsc1CCOCCCOC2CCCCC2 3e30ea3e337614e9e17ddcba2bf568e7 [1,0,0,1,0,0|1,0,1]=4 813 B20R2.8552 Cc1ncsc1CCOCCCCCN2CCCC2 332301f7c89041ca907ad52a261b69e4 [1,0,0,1,0,0|1,0,1]=4 814 B20R2.74715 Cc1ncsc1CCOCCCN2CCCCC2C 02934c807480b4fe9311ee3cc2fbc732 [1,0,0,1,0,0|1,0,1]=4 815 B20R2.176814 CCCCCC1CCCC1OCCc2scnc2C 9a44dcdd14ca02f7311d9fc10cfffbfd [1,0,0,1,0,0|0,0,1]=3 816 B20R2.270788 CCC1CCCCN1CCOCCc2scnc2C eb73f93f7b97d36850127865a0a46e62 [1,0,0,1,0,0|1,0,1]=4 817 B20R2.2737686 Cc1ncsc1CCOCCCN2CCCCCC2 2dbd778604efc4debfffc36f05a93761 [1,0,0,1,0,0|1,0,1]=4 818 B20R2.2741283 Cc1ncsc1CCNCCC2CCCCCCC2 620ddba5a29c2028273f1e42429d4b02 [1,0,0,1,0,0|1,0,1]=4 819 B20R2.4868 Cc1ccsc1CCNC(=O)CCC2CCCCC2 4324f4aed5ba5ef1d62d765fdfc844d5 [1,0,0,1,0,0|2,0,0]=4 820 B20R2.4868 Cc1ncsc1CCNC(=O)CCC2CCCCC2 98ec2f54505f2c52fec4fbb4c99f05b0 [1,0,0,1,0,0|1,0,0]=3 821 B20R2.4868 Cc1ncsc1CCNC(=O)CCC2CCOCC2 e1e6967165b1629ff6d06b0dad4cff90 [1,0,0,1,0,0|2,0,0]=4 822 B20R2.4868 Cc1ncsc1CCNC(=O)CCN2CCCCC2 0452c28f5efbfa50d7517dcefc0aa587 [1,0,0,1,0,0|2,0,0]=4 823 B20R2.4868 Cc1ncsc1CCNC(=O)COC2CCCCC2 6235baa7bef281ed6a0e4cc13e97d5be [1,0,0,1,0,0|2,0,0]=4 824 B20R2.4868 Cc1ncsc1CCNC(=O)NCC2CCCCC2 fe77cfc87df2e4bc0dda17944061fa28 [1,0,0,1,0,0|2,0,0]=4 825 B20R2.41969 CCN1CCCCC1C(=O)NCCc2scnc2C 11cc4f67bb735d26765e505350933625 [1,0,0,1,0,0|2,0,0]=4 826 B20R2.46929 CCCCCCCCC(=O)N1CCc2sccc2C1 d0d5bdb08c480afb1ae11b3f002981c5 [1,0,0,1,0,0|2,0,0]=4 827 B20R2.46929 CCCCCCCCC(=O)N1CCc2scnc2C1 38b5d7072d29ca085aaa131b6440095a [1,0,0,1,0,0|1,0,0]=3 828 B20R2.46929 CCCCCCCNC(=O)N1CCc2scnc2C1 d97c35d98d4f03ff09fbf7cd0f31bed6 [1,0,0,1,0,0|2,0,0]=4 829 B20R2.46929 CSCCCCCCC(=O)N1CCc2scnc2C1 02168366ad8fa755f836e8a7a636a576 [1,0,0,1,0,0|2,0,0]=4 830 B20R2.46929 O=C(CCCCCCCF)N1CCc2scnc2C1 58af6a1a17f9670ab4d6aba6ed007c42 [1,0,0,1,0,0|2,0,0]=4 831 B20R2.46929 O=C(CCCCCCCO)N1CCc2scnc2C1 bb443a6dbff14e86e484637da23faa88 [1,0,0,1,0,0|2,0,0]=4 832 B20R2.46929 O=C(CCCCCCCS)N1CCc2scnc2C1 569f2d751c3b2d283614b4f30cbf2da9 [1,0,0,1,0,0|2,0,0]=4 833 B20R2.74641 Cc1ccsc1CCNC(=O)CC2CCCCC2C 0cd681e7762b4b0fb1481e3c17303508 [1,0,0,1,0,0|2,0,0]=4 834 B20R2.74641 Cc1ncsc1CCNC(=O)CC2CCCCC2C db20df250932c8d446d6ef261c20ddff [1,0,0,1,0,0|1,0,0]=3 835 B20R2.74641 Cc1ncsc1CCNC(=O)CC2CCCCN2C 00e00903fa407e6de8a40ac09a932e11 [1,0,0,1,0,0|2,0,0]=4 836 B20R2.74641 Cc1ncsc1CCNC(=O)CN2CCCCC2C dfc9f2cdbaf34c033305a80e6d45979a [1,0,0,1,0,0|2,0,0]=4 837 B20R2.74641 Cc1ncsc1CCNC(=O)NC2CCCCC2C fc3032107322e17d4bb1f94981e830a9 [1,0,0,1,0,0|2,0,0]=4 838 B20R2.74641 Cc1ncsc1CCNC(=O)N[C@@H]2CCCC[C@@H]2C 4af25b27f35f9bf700bcc63068667bd3 [1,0,0,1,0,0|2,0,0]=4 839 B20R2.74641 Cc1ncsc1CCNC(=O)N[C@@H]2CCCC[C@H]2C 1355e247864528ba11c434227a1160d7 [1,0,0,1,0,0|2,0,0]=4 840 B20R2.74641 Cc1ncsc1CCNC(=O)N[C@H]2CCCC[C@@H]2C 0bec67c720bc0da179c0261366e30dd0 [1,0,0,1,0,0|2,0,0]=4 841 B20R2.74641 Cc1ncsc1CCNC(=O)N[C@H]2CCCC[C@H]2C 11d6790e3e4015dcb99177d9ca2de216 [1,0,0,1,0,0|2,0,0]=4 842 B20R2.144088 Cc1ncsc1CCNC(=O)C2CCCCCN2C 5927e6d61e8681d6d9b2080a09804d9d [1,0,0,1,0,0|2,0,0]=4 843 B20R2.188669 CCCN1CCCC1C(=O)NCCc2scnc2C 996978e78d3b97a5c5045aa0ca4a3b96 [1,0,0,1,0,0|2,0,0]=4 844 B20R2.2740378 Cc1ncsc1CCNC(=O)N2CCCCCCC2 0a4426697e82e85fd9cfb7cf1b6a40e3 [1,0,0,1,0,0|2,0,0]=4 845 B20R2.2742199 Cc1ccsc1CCNC(=O)CC2CCCCCC2 e95300f5b62295a890774889c2428625 [1,0,0,1,0,0|2,0,0]=4 846 B20R2.2742199 Cc1ncsc1CCNC(=O)CC2CCCCCC2 965afee2adb849ef90d887bb63aacc09 [1,0,0,1,0,0|1,0,0]=3 847 B20R2.2742199 Cc1ncsc1CCNC(=O)CN2CCCCCC2 222ecbae109e76e89163a54aa7f66b72 [1,0,0,1,0,0|2,0,0]=4 848 B20R2.4864 Cc1ccsc1CCC(=O)NCCC2CCCCC2 66356af55a9d2cd0b5c90cfd3aa3d878 [0,0,0,1,1,0|2,0,0]=4 849 B20R2.4864 Cc1ncsc1CCC(=O)NCCC2CCCCC2 25e6a1c6e78d1a9f677641f6849ad3c9 [0,0,0,1,1,0|1,0,0]=3 850 B20R2.4864 Cc1ncsc1CCC(=O)NCCC2CCCCO2 e69369e48719ed2c776c551cf959d5ac [0,0,0,1,1,0|2,0,0]=4 851 B20R2.4864 Cc1ncsc1CCC(=O)NCCC2CCCOC2 56b3c4d947d1592c2a24dc4b4973a612 [0,0,0,1,1,0|2,0,0]=4 852 B20R2.4864 Cc1ncsc1CCC(=O)NCCC2CCOCC2 3435839af41f3a624e537c04b0603c44 [0,0,0,1,1,0|2,0,0]=4 853 B20R2.4864 Cc1ncsc1CCC(=O)NCCC2CCSCC2 8893f54220b2bdc552c5540a61556623 [0,0,0,1,1,0|2,0,0]=4 854 B20R2.4864 Cc1ncsc1CCC(=O)NCCN2CCCCC2 49e26c712e92c67faefcd45000f57ea2 [0,0,0,1,1,0|2,0,0]=4 855 B20R2.4864 Cc1ncsc1CNC(=O)CCCC2CCCCC2 fe44f4b45a3b1e79ed457901067bbac0 [0,0,0,1,1,0|1,0,0]=3 856 B20R2.4864 Cc1ncsc1CNC(=O)CCCN2CCCCC2 0859ee29252e68631f0ed6e2c7495f9e [0,0,0,1,1,0|2,0,0]=4 857 B20R2.4864 Cc1ncsc1CNC(=O)NCCC2CCCCC2 06aee40d6c7d7fc6b00b87614810f3ba [0,0,0,1,1,0|2,0,0]=4 858 B20R2.4864 Cc1ncsc1NCC(=O)NCCC2CCCCC2 8c2323dce51f4b02cce8a06ed615f319 [0,0,0,1,1,0|2,0,0]=4 859 B20R2.4864 Cc1nnsc1CNC(=O)CCCC2CCCCC2 6b49ced3f1366d932bd036c3e6a3f57d [0,0,0,1,1,0|2,0,0]=4 860 B20R2.4864 O=C(CCCC1CCCCC1)NCc2scnc2Br 9bb215d80737c5685d9829ce169d2f9f [0,0,0,1,1,0|2,0,0]=4 861 B20R2.42200 CCC1CCCCN1CC(=O)NCc2scnc2C 1982e486d4f7ba383451ca22ee380edf [0,0,0,1,1,0|2,0,0]=4 862 B20R2.42200 CCC1COCCC1NC(=O)CCc2scnc2C a8dbbb540edc7848971d70fe3c0950c8 [0,0,0,1,1,0|2,0,0]=4 863 B20R2.42200 COC1CCCCC1NC(=O)CCc2scnc2C abd175ead528346c13381c8fe7cbcce2 [0,0,0,1,1,0|2,0,0]=4 864 B20R2.42200 CO[C@H]1CCCC[C@@H]1NC(=O)CCc2scnc2C efec4438c95d86d7d496cb79bcc41329 [0,0,0,1,1,0|2,0,0]=4 865 B20R2.42200 Cc1ncsc1CCC(=O)N[C@@H]2CCCC[C@@H]2CO cedfed8dae99e5f40687203338fb75fb [0,0,0,1,1,0|2,0,0]=4 866 B20R2.42200 Cc1ncsc1CCC(=O)N[C@@H]2CCCC[C@H]2CO 4947bd3e9c9f595f789451d23e4653f3 [0,0,0,1,1,0|2,0,0]=4 867 B20R2.42200 Cc1ncsc1CCC(=O)N[C@H]2CCCC[C@H]2CO 59aa83a96fab03379849fee9500bf563 [0,0,0,1,1,0|2,0,0]=4 868 B20R2.46058 CCN1CCCC1CNC(=O)CCc2scnc2C 758688c01062380f4a2fe983699c603e [0,0,0,1,1,0|2,0,0]=4 869 B20R2.46058 CCN1CCC[C@@H]1CNC(=O)CCc2scnc2C 5b7471e5e96a81b77b70895885eef47d [0,0,0,1,1,0|2,0,0]=4 870 B20R2.46058 CCN1CCC[C@H]1CNC(=O)CCc2scnc2C f50ec8236f7d90c5e0688f4dc35b3e18 [0,0,0,1,1,0|2,0,0]=4 871 B20R2.74835 Cc1ccsc1CCC(=O)NCC2CCCCC2C 02ecb066c2d1d9a1ad87d47e4884270d [0,0,0,1,1,0|2,0,0]=4 872 B20R2.74835 Cc1ncsc1CCC(=O)NCC2CCCCC2C 5c1afd5b5f93c1b95bf11b1e43706865 [0,0,0,1,1,0|1,0,0]=3 873 B20R2.74835 Cc1ncsc1CCC(=O)NCC2CCCCC2O b3682106e5ba07ec8cb0a5bde556304f [0,0,0,1,1,0|2,0,0]=4 874 B20R2.74835 Cc1ncsc1CCC(=O)NCC2CCCCN2C 963415e01cba366abf287a5caf175159 [0,0,0,1,1,0|2,0,0]=4 875 B20R2.74835 Cc1ncsc1CNC(=O)CCN2CCCCC2C de2573c493256d17b300b27aa22c59e0 [0,0,0,1,1,0|2,0,0]=4 876 B20R2.74835 Cc1ncsc1CNC(=O)COC2CCCCC2C 5e3c0482f27f9a7fc73cdc61c5f0e098 [0,0,0,1,1,0|2,0,0]=4 877 B20R2.74835 Cc1ncsc1CNC(=O)NCC2CCCCC2C 44daf61fa2419999dbb7c714726c0fe7 [0,0,0,1,1,0|2,0,0]=4 878 B20R2.77168 Cc1ccsc1CCC(=O)NCCCC2CCCC2 4cfb5a1e656d8ee71e11d3c7c8ab0260 [0,0,0,1,1,0|2,0,0]=4 879 B20R2.77168 Cc1ncsc1CCC(=O)NCCCC2CCCC2 4694eaf2d47828f57fd2eb82642db422 [0,0,0,1,1,0|1,0,0]=3 880 B20R2.77168 Cc1ncsc1CCC(=O)NCCCC2CCOC2 fe8d906b1ab6917a4de603ce1d5ebc8c [0,0,0,1,1,0|2,0,0]=4 881 B20R2.77168 Cc1ncsc1CCC(=O)NCCCN2CCCC2 186205b31b951828f90e0cd586f311af [0,0,0,1,1,0|2,0,0]=4 882 B20R2.77168 Cc1ncsc1CCC(=O)NCCOC2CCCC2 2407a2378f9143cfb7a61a841781e245 [0,0,0,1,1,0|2,0,0]=4 883 B20R2.77168 Cc1ncsc1CCC(=O)NCCSC2CCCC2 4f0f880f916ebb01644505fc5ed75c6a [0,0,0,1,1,0|2,0,0]=4 884 B20R2.77168 Cc1ncsc1CNC(=O)NCCCC2CCCC2 4806922d827ed3091bafba011718ee3a [0,0,0,1,1,0|2,0,0]=4 885 B20R2.143950 Cc1ncsc1CCC(=O)N[C@@H]2CCCCC[C@@H]2O 4c7f7c8c95326b38c461a66d8ac34c77 [0,0,0,1,1,0|2,0,0]=4 886 B20R2.143950 Cc1ncsc1CCC(=O)N[C@@H]2CCCCC[C@H]2O 41f503491f74702168c46aa9a5b0d055 [0,0,0,1,1,0|2,0,0]=4 887 B20R2.143950 Cc1ncsc1CCC(=O)N[C@H]2CCCCC[C@@H]2O cff07040ea556834ebe0b3efd5d4c8f5 [0,0,0,1,1,0|2,0,0]=4 888 B20R2.185621 CCCC1COCCN1C(=O)CCc2scnc2C 5ce45dbee152edf7b941c6069ffc075c [0,0,0,1,1,0|2,0,0]=4 889 B20R2.185621 CCCN1CCCCC1C(=O)NCc2scnc2C c468d6be0e04e4f3bebcb9e759beef46 [0,0,0,1,1,0|2,0,0]=4 890 B20R2.185621 COCC1CCCCN1C(=O)CCc2scnc2C f27f0adb4c9a27727099af6c4e68a80d [0,0,0,1,1,0|2,0,0]=4 891 B20R2.185621 Cc1ncsc1CCC(=O)N2CCCCC2CCCl 2b67c1f6bd4cfcf49edd9a32885a7d8a [0,0,0,1,1,0|2,0,0]=4 892 B20R2.185621 Cc1ncsc1CCC(=O)N2CCCCC2CCO 9ac8d765db11bd5dcfbcc20a7702bfb2 [0,0,0,1,1,0|2,0,0]=4 893 B20R2.185621 Cc1ncsc1CCC(=O)N2CCCC[C@@H]2CCO 878222c40da3a2401bb6e5e2731a3f8d [0,0,0,1,1,0|2,0,0]=4 894 B20R2.185621 Cc1ncsc1CCC(=O)N2CCCC[C@H]2CCO 4a3897d0c20f59ffc24b0602ebbadc38 [0,0,0,1,1,0|2,0,0]=4 895 B20R2.188966 COC[C@@H]1CCC[C@@H]1NC(=O)CCc2scnc2C 3e70fe38a97907a8e88120e119aadfae [0,0,0,1,1,0|2,0,0]=4 896 B20R2.188966 COC[C@H]1CCC[C@H]1NC(=O)CCc2scnc2C 3aefa4aed3a60fa58426c4862e62eaaf [0,0,0,1,1,0|2,0,0]=4 897 B20R2.189885 CCCCCCCCCC(=O)N1Cc2ncsc2C1 5cca5cb1e60ac926d26dc91d49bb53c2 [0,0,0,1,1,0|1,0,0]=3 898 B20R2.189885 CCCCCCCCNC(=O)N1Cc2ncsc2C1 7bbc2f49be958ea238c8ab65c9a419f3 [0,0,0,1,1,0|2,0,0]=4 899 B20R2.189885 O=C(CCCCCCCCO)N1Cc2ncsc2C1 5e2b969b5574dba94a058bd1e48f96ee [0,0,0,1,1,0|2,0,0]=4 900 B20R2.189885 O=C(CCCCCCCCS)N1Cc2ncsc2C1 23fe724e00a69053b28c9a43f9f80b0d [0,0,0,1,1,0|2,0,0]=4 901 B20R2.213410 CCCCC1CCCN1C(=O)CCc2sccc2C 0b88b8b2b4d462ed25ce1fab1c69d9de [0,0,0,1,1,0|2,0,0]=4 902 B20R2.213410 CCCCC1CCCN1C(=O)CCc2scnc2C 2e6eec6183af409e8f4ea827a951e40e [0,0,0,1,1,0|1,0,0]=3 903 B20R2.213410 CCCCC1CCCN1C(=O)NCc2scnc2C 1812b958ff55dd848427e4a5b9f8e16e [0,0,0,1,1,0|2,0,0]=4 904 B20R2.213410 CCOCC1CCCN1C(=O)CCc2scnc2C 7f8f2229cf59f1fcd03871f5015b5db9 [0,0,0,1,1,0|2,0,0]=4 905 B20R2.213410 CCOC[C@@H]1CCCN1C(=O)CCc2scnc2C 5d1ceb25aec126b37c1e9d32607bd4d8 [0,0,0,1,1,0|2,0,0]=4 906 B20R2.213410 COCCC1CCCN1C(=O)CCc2scnc2C d0d4630cc9f8b67249229acab76b059f [0,0,0,1,1,0|2,0,0]=4 907 B20R2.277790 Cc1ncsc1CCC(=O)N2CCCCCC2CO 1b32cfefa0cffe352e8ef04ccb4d602d [0,0,0,1,1,0|2,0,0]=4 908 B20R2.2740473 Cc1ccsc1CCC(=O)N2CCCCCCCC2 73ad62a05f7f71dc6a509fe42623bdb3 [0,0,0,1,1,0|2,0,0]=4 909 B20R2.2740473 Cc1ncsc1CCC(=O)N2CCCCCCCC2 e3267559303a03551d1a3bf0a56def1f [0,0,0,1,1,0|1,0,0]=3 910 B20R2.2740473 Cc1ncsc1CNC(=O)N2CCCCCCCC2 754f91c3fa14b64674e7fa3705058ba7 [0,0,0,1,1,0|2,0,0]=4 911 B20R2.2740498 Cc1ncsc1CCC(=O)NCCCOCC2CC2 7bfc486c65557037192d805683ea7a47 [0,0,0,1,1,0|2,0,0]=4 912 B20R2.2741262 Cc1ccsc1CCC(=O)NCC2CCCCCC2 eafe21a4625b360a6a6c4a1ffb41244e [0,0,0,1,1,0|2,0,0]=4 913 B20R2.2741262 Cc1ncsc1CCC(=O)NCC2CCCCCC2 c5813089f2572aab8b9a0b44aa987857 [0,0,0,1,1,0|1,0,0]=3 914 B20R2.2741262 Cc1ncsc1CNC(=O)CCN2CCCCCC2 e86b4d9aa9591146735062bb3b3b2377 [0,0,0,1,1,0|2,0,0]=4 915 B20R2.2741262 Cc1ncsc1CNC(=O)NCC2CCCCCC2 21ef045e76f956e398f3bf685bf71641 [0,0,0,1,1,0|2,0,0]=4 916 B20R2.2862765 Cc1ccsc1CCC(=O)NC2CCCCCCC2 9d1f254f3d08fd51aa9d7825a19f429e [0,0,0,1,1,0|2,0,0]=4 917 B20R2.2862765 Cc1ncsc1CCC(=O)NC2CCCCCCC2 ade29033fb7e951fad51db30a38b168d [0,0,0,1,1,0|1,0,0]=3 918 B20R2.2862765 Cc1ncsc1CNC(=O)CN2CCCCCCC2 ae7842b4db346a0417348660917e4241 [0,0,0,1,1,0|2,0,0]=4 919 B20R2.2862765 Cc1ncsc1CNC(=O)NC2CCCCCCC2 d51afb0edceea00f6d51cf820d940db0 [0,0,0,1,1,0|2,0,0]=4 920 B20R2.2862765 Cc1ncsc1NCC(=O)NC2CCCCCCC2 370f190c2197063c8297235281dabc1c [0,0,0,1,1,0|2,0,0]=4 921 B22R2.11062 Cc1ncsc1CCCNC(=O)CCCC2CCCCC2 3479658773ef516c9b9092579f0f0c4a [0,0,0,1,0,1|1,0,0]=3 922 B22R2.11062 Cc1ncsc1CCCNC(=O)CCCN2CCCCC2 04e9e24173b21e339608ef75716ee5ad [0,0,0,1,0,1|2,0,0]=4 923 B22R2.11062 Cc1ncsc1CCCNC(=O)NCCC2CCCCC2 2fee8e00bd959babf75be68fd6d8db12 [0,0,0,1,0,1|2,0,0]=4 924 B22R2.11062 Cc1ncsc1CCNCC(=O)NCCC2CCCCC2 b856bc27db2d596994efc0b5f4c948db [0,0,0,1,0,1|2,0,0]=4 925 B22R2.11062 Cc1ncsc1CCOCC(=O)NCCC2CCCCC2 f505726747abae57957efe5ff01b3f24 [0,0,0,1,0,1|1,0,0]=3 926 B22R2.82224 CCC1CCCCN1CC(=O)NCCCc2scnc2C 13c902ad46d9013d7e21323b30201e1c [0,0,0,1,0,1|2,0,0]=4 927 B22R2.149187 Cc1ncsc1CCCNC(=O)NCCCC2CCCC2 9a66f149ebfbf0fe8f9c11f048eed9c6 [0,0,0,1,0,1|2,0,0]=4 928 B22R2.201669 Cc1ncsc1CCCNC(=O)CCN2CCCCC2C aaf5c480c5cb1fc29acc4bf56e7aebe8 [0,0,0,1,0,1|2,0,0]=4 929 B22R2.201669 Cc1ncsc1CCCNC(=O)COC2CCCCC2C cd9bea6c6c8612fb32c4a41d7328f489 [0,0,0,1,0,1|2,0,0]=4 930 B22R2.201669 Cc1ncsc1CCCNC(=O)NCC2CCCCC2C 2b10f45e4ad2627a70da685838c75835 [0,0,0,1,0,1|2,0,0]=4 931 B22R2.389659 CCCN1CCCCC1C(=O)NCCCc2scnc2C 8ccb447a0f3c5dd98a2d705b2e5c4804 [0,0,0,1,0,1|2,0,0]=4 932 B22R2.581463 CCCCC1CCCN1C(=O)NCCCc2scnc2C 432a9d36ddca1566b0e85b0bc15d61bf [0,0,0,1,0,1|2,0,0]=4 933 B22R2.4111941 Cc1ncsc1CCCNC(=O)N2CCCCCCCC2 8a04bc910d1d37f1e1faec90c5cb21d6 [0,0,0,1,0,1|2,0,0]=4 934 B22R2.4515540 Cc1ncsc1CCCNC(=O)CN2CCCCCCC2 cb72ae993383325e350f93077585aa04 [0,0,0,1,0,1|2,0,0]=4 935 B22R2.4515540 Cc1ncsc1CCNCC(=O)NC2CCCCCCC2 e5c863836d853d52fcadaaf5ca3c87a4 [0,0,0,1,0,1|2,0,0]=4 936 B22R2.4515540 Cc1ncsc1CCOCC(=O)NC2CCCCCCC2 18d558666abe48c07814478f7409e26c [0,0,0,1,0,1|1,0,0]=3 937 B22R2.4515540 Cc1ncsc1CNCCC(=O)NC2CCCCCCC2 d3b92c195cd68d5e749d5227c03fd24c [0,0,0,1,0,1|2,0,0]=4 938 B22R2.5906751 Cc1ncsc1CCCNC(=O)CCN2CCCCCC2 733ad1f91a6d29546a28e0cc6b6085e3 [0,0,0,1,0,1|2,0,0]=4 939 B22R2.5906751 Cc1ncsc1CCCNC(=O)NCC2CCCCCC2 b3bc38cdf82bc06c23e98068e9b2163c [0,0,0,1,0,1|2,0,0]=4 940 B22R2.4535 Cc1cc(ccn1)CCNC(=O)CCCC2CCCCC2 13f5d98fb0d7d8694a512222a6c08fe2 [0,0,0,1,0,1|2,0,0]=4 941 B22R2.398436 CCCCCCCCCC(=O)NC1Cc2cccnc2C1 a0181279b3abc124e4d0f3daf2f01e0a [0,0,0,1,0,1|2,0,0]=4 942 B22R2.398436 CCCCCCCCCC(=O)NC1Cc2ccncc2C1 b44528f296a0a8d0a5a952fb5894768a [0,0,0,1,0,1|2,0,0]=4 943 B22R2.398469 CCCCCCCCCC(=O)N1CCc2cccnc2C1 74943646bf8b7f7b85b9b162aee83576 [0,0,0,1,0,1|2,0,0]=4 944 B22R2.398469 CCCCCCCCCC(=O)N1CCc2ccncc2C1 5c3c0869c338ff949c7101d5c2767312 [0,0,0,1,0,1|2,0,0]=4 945 B22R2.398469 CCCCCCCCCC(=O)N1CCc2nccnc2C1 085f52ce4792bc6b6117f7b9978587f0 [0,0,0,1,0,1|2,0,0]=4 946 B22R2.398469 CCCCCCCCCC(=O)N1CCc2ncncc2C1 0b4db4cccc0be68e7ef8305bb4a41ad5 [0,0,0,1,0,1|2,0,0]=4 947 B22R2.148736 Cc1ncsc1CCNC(=O)C2CCCCN2CC(C)C ace6c4d652270f7fb8195d2937451e0d [0,1,0,1,0,0|2,0,0]=4 948 B22R2.586769 CC(=O)CCCCCCCC(=O)N1CCc2scnc2C1 357809cdf4a037f7275c502ca7bd51a0 [0,1,0,1,0,0|1,0,1]=4 949 B22R2.586769 CC(C)CCCCCCNC(=O)N1CCc2scnc2C1 6397e5153c43d52ac79ec1739e8a0782 [0,1,0,1,0,0|2,0,0]=4 950 B22R2.398453 CCCCCCCCCC(=O)N1CCc2sccc2C1C 81f081ef1ff69ce1bf3a5ab31e3930bc [0,1,0,1,0,0|2,0,0]=4 951 B22R2.82147 CCN1CCCCC1CNC(=O)NCCc2scnc2C 861caf5aa4a1f67e6b4f0d9681ba7858 [0,1,0,1,0,0|2,0,0]=4 952 B22R2.148546 Cc1ccsc1CCNC(=O)CCCCC2CCCCC2 e464da47933fddaa8ae06f4795e1dce0 [0,1,0,1,0,0|2,0,0]=4 953 B22R2.148546 Cc1ccsc1CCNC(=O)CCCCN2CCCCC2 c2422c44174abe3369e7c6d400de275f [0,1,0,1,0,0|2,0,0]=4 954 B22R2.148546 Cc1ccsc1CCNC(=O)CCCSC2CCCCC2 7262d7a8881a7cd556352f857f6bcfc3 [0,1,0,1,0,0|2,0,0]=4 955 B22R2.148546 Cc1ccsc1CCNC(=O)CCOCC2CCCCC2 33fee1a419d0f652b145f5721c31d0a2 [0,1,0,1,0,0|2,0,0]=4 956 B22R2.148546 Cc1ccsc1CCNC(=O)CCSCC2CCCCC2 5d582a50e3301b9123e8e83e090b61ad [0,1,0,1,0,0|2,0,0]=4 957 B22R2.148546 Cc1ncsc1CCNC(=O)CCCCC2CCCCC2 ccb11156779ce1d09b2185cd97e38ed3 [0,1,0,1,0,0|1,0,0]=3 958 B22R2.148546 Cc1ncsc1CCNC(=O)CCCCN2CCCCC2 c3e0e4710d56f3239e5a6b8482ec7730 [0,1,0,1,0,0|1,0,0]=3 959 B22R2.148546 Cc1ncsc1CCNC(=O)CCCCN2CCOCC2 3e452511f13f6b93c5e9f3766b4020d1 [0,1,0,1,0,0|2,0,0]=4 960 B22R2.148546 Cc1ncsc1CCNC(=O)CCCSC2CCCCC2 86124105d55722533f525953abfed446 [0,1,0,1,0,0|1,0,0]=3 961 B22R2.148546 Cc1ncsc1CCNC(=O)CCOCC2CCCCC2 aa88d7fb46b21e7c59f4448033ef4ac6 [0,1,0,1,0,0|1,0,0]=3 962 B22R2.148546 Cc1ncsc1CCNC(=O)CCSCC2CCCCC2 a0134047c9cc402897de3a89ceff1c76 [0,1,0,1,0,0|1,0,0]=3 963 B22R2.148546 Cc1ncsc1CCNC(=O)NCCCC2CCCCC2 27817f024f5d2d34a27f9b46b6933d6d [0,1,0,1,0,0|1,0,0]=3 964 B22R2.148546 Cc1ncsc1CCNC(=O)NCCCN2CCCCC2 c79d72632924c57c928a0b70d9d90c4c [0,1,0,1,0,0|2,0,0]=4 965 B22R2.148546 Cc1ncsc1CCNC(=O)NCCSC2CCCCC2 100de9b5c33a1e70741b3f59e5222d68 [0,1,0,1,0,0|2,0,0]=4 966 B22R2.148546 Cc1ncsc1CCNC(=S)NCCCC2CCCCC2 a1c804c8db8a4ee3ddf5caae685a1f7a [0,1,0,1,0,0|1,1,0]=4 967 B22R2.148546 Cc1ncsc1CNCC(=O)NCCCC2CCCCC2 b3029e65a90631d7e0c60b7719da2dc6 [0,1,0,1,0,0|2,0,0]=4 968 B22R2.148546 Cc1ncsc1COCC(=O)NCCCC2CCCCC2 6e586b0bd5a1417b350e228a4a5c7322 [0,1,0,1,0,0|2,0,0]=4 969 B22R2.148741 Cc1ccsc1CCNC(=O)CCCCCN2CCCC2 af373651d80d9eac43acc8f2815ab809 [0,1,0,1,0,0|2,0,0]=4 970 B22R2.148741 Cc1ccsc1CCNC(=O)NCCCCC2CCCC2 6fef8fabf83a90d7fc4afa1cd95d0273 [0,1,0,1,0,0|2,0,0]=4 971 B22R2.148741 Cc1ncsc1CCNC(=O)CCCCCN2CCCC2 89ec94289120e2c11d2f858f3a718faa [0,1,0,1,0,0|1,0,0]=3 972 B22R2.148741 Cc1ncsc1CCNC(=O)NCCCCC2CCCC2 9abf9b6b75351d9d6b377bb0de5106ef [0,1,0,1,0,0|1,0,0]=3 973 B22R2.148741 Cc1ncsc1CCNC(=O)NCCCCN2CCCC2 083a4486731e7d81b10d83ad3f7f42d0 [0,1,0,1,0,0|2,0,0]=4 974 B22R2.148741 Cc1ncsc1CCNC(=O)NCCCOC2CCCC2 4300976b93ce9ed5100e57c19337a823 [0,1,0,1,0,0|2,0,0]=4 975 B22R2.148741 Cc1ncsc1CCNC(=S)NCCCCC2CCCC2 61cd012a69faa79a2be318edcd612fe4 [0,1,0,1,0,0|1,1,0]=4 976 B22R2.286741 Cc1ncsc1CNC2CCCCCCCCCCC2=O 9d96a3d44c6102460d59c44fc7cfc122 [0,1,0,1,0,0|2,0,0]=4 977 B22R2.574850 Cc1ncsc1CCNC(=O)N2CCCCC2CCCO b62321602474109e64c84b7769c30b4e [0,1,0,1,0,0|2,0,0]=4 978 B22R2.580378 CCCCC1CCCC1NC(=O)NCCc2sccc2C 93f163608cd7ece63b699e3cbb65429a [0,1,0,1,0,0|2,0,0]=4 979 B22R2.580378 CCCCC1CCCC1NC(=O)NCCc2scnc2C d59ba325ae90ec63e2739b1783075545 [0,1,0,1,0,0|1,0,0]=3 980 B22R2.580378 CCCCC1CCCC1NC(=S)NCCc2scnc2C 72cd671f7846c8f9bb76fd90d981a5ac [0,1,0,1,0,0|1,1,0]=4 981 B22R2.582032 C#CCCCCCCCCC(=O)N1CCc2scnc2C1 07d8875e6a43cf4f331dd31c83ad9a4c [0,1,0,1,0,0|1,0,1]=4 982 B22R2.582032 C=CCCCCCCCCC(=O)N1CCc2scnc2C1 0f9974c5e05e806545864d41dd4a083b [0,1,0,1,0,0|1,0,1]=4 983 B22R2.582032 CCCCCCCC/C=C/C(=O)N1CCc2scnc2C1 126780a0958184ad69552e00c0522f11 [0,1,0,1,0,0|1,0,1]=4 984 B22R2.582032 CCCCCCCCC=CC(=O)N1CCc2scnc2C1 59f5c63ee496a42a39d59821af1c9dc3 [0,1,0,1,0,0|1,0,1]=4 985 B22R2.582032 CCCCCCCCCCC(=O)N1CCc2sccc2C1 689ac71c95513e4b2bc57c3ebe632da8 [0,1,0,1,0,0|2,0,0]=4 986 B22R2.582032 CCCCCCCCCCC(=O)N1CCc2scnc2C1 5dd4b64732789459bcb964e6ebf9a334 [0,1,0,1,0,0|1,0,0]=3 987 B22R2.582032 CCCCCCCCCNC(=O)N1CCc2[nH]cnc2C1 16c0409db66e2c01f41db391fd4db763 [0,1,0,1,0,0|2,0,0]=4 988 B22R2.582032 CCCCCCCCCNC(=O)N1CCc2sccc2C1 9519a9722b4963a1b2637fa0f447eaac [0,1,0,1,0,0|2,0,0]=4 989 B22R2.582032 CCCCCCCCCNC(=O)N1CCc2scnc2C1 6d4139a0b214b736d22f64b163a4bd77 [0,1,0,1,0,0|1,0,0]=3 990 B22R2.582032 CCCCCCCCCNC(=S)N1CCc2scnc2C1 83269d375355d2b53e71cf28daf78c86 [0,1,0,1,0,0|1,1,0]=4 991 B22R2.582032 CCCCCCCCNCC(=O)N1CCc2sccc2C1 eaa9735cdf455037e1768439fe346396 [0,1,0,1,0,0|2,0,0]=4 992 B22R2.582032 CCCCCCCCOCC(=O)N1CCc2sccc2C1 dd7b0a2ce9cc69f20d72158d38ea3c81 [0,1,0,1,0,0|2,0,0]=4 993 B22R2.582032 CCCCCCCCOCC(=O)N1CCc2scnc2C1 56e0614b8a890e01c16efea7fcf6182f [0,1,0,1,0,0|1,0,0]=3 994 B22R2.582032 CCCCCCCNCCC(=O)N1CCc2sccc2C1 7f8020d183483d0d86c8bc328363c468 [0,1,0,1,0,0|2,0,0]=4 995 B22R2.582032 CCCCCCCOCCC(=O)N1CCc2sccc2C1 5e0faab61a55fc3a6995d38c1550bcec [0,1,0,1,0,0|2,0,0]=4 996 B22R2.582032 COCCOCCCCCC(=O)N1CCc2scnc2C1 b0c44d3c34504c7d5c1768c1211c4f97 [0,1,0,1,0,0|2,0,0]=4 997 B22R2.582032 NCCCCCCCCNC(=O)N1CCc2scnc2C1 fb30adea75307ff6d3a26a4ae874c588 [0,1,0,1,0,0|2,0,0]=4 998 B22R2.582032 O=C(CCCCCCCCCF)N1CCc2sccc2C1 b503d1d9598e66df091c08aa19820a0a [0,1,0,1,0,0|2,0,0]=4 999 B22R2.582032 O=C(CCCCCCCCCF)N1CCc2scnc2C1 5767ce521ed092bcc0ad9277fce1a23c [0,1,0,1,0,0|1,0,0]=3 1000 B22R2.582032 O=C(CCCCCCCCCO)N1CCc2sccc2C1 06c0cc672b65f3c2cc3dc16f1bbd2429 [0,1,0,1,0,0|2,0,0]=4 1001 B22R2.582032 O=C(CCCCCCCCCO)N1CCc2scnc2C1 e4767be078462b21981e2c05a0009add [0,1,0,1,0,0|1,0,0]=3 1002 B22R2.582032 O=C(NCCCCCCCCO)N1CCc2scnc2C1 23c74e7bd3a1e0a3903b559f6fb463b1 [0,1,0,1,0,0|2,0,0]=4 1003 B22R2.582032 O=CCCCCCCCCC(=O)N1CCc2scnc2C1 3753eb53e46697ff73ea5ffbf3a167a9 [0,1,0,1,0,0|1,0,1]=4 1004 B22R2.4107809 Cc1ccsc1CCNC(=O)CCCN2CCCCCC2 93e66c8156d42d9b2d6b6cb96e439d17 [0,1,0,1,0,0|2,0,0]=4 1005 B22R2.4107809 Cc1ccsc1CCNC(=O)NCCC2CCCCCC2 1f7eced3f96d3e23d69dfe8ebb674099 [0,1,0,1,0,0|2,0,0]=4 1006 B22R2.4107809 Cc1ncsc1CCNC(=O)CCCN2CCCCCC2 6a70d057603d0b182617259c5ed59250 [0,1,0,1,0,0|1,0,0]=3 1007 B22R2.4107809 Cc1ncsc1CCNC(=O)NCCC2CCCCCC2 1c07bb76ed74bce3cb6ddf0cc8ae2d08 [0,1,0,1,0,0|1,0,0]=3 1008 B22R2.4107809 Cc1ncsc1CCNC(=O)NCCN2CCCCCC2 44a2381dfcbfb645e546f14e2cf24edb [0,1,0,1,0,0|2,0,0]=4 1009 B22R2.4107809 Cc1ncsc1CCNC(=S)NCCC2CCCCCC2 00905fdd33cb989385df094ada6c7b45 [0,1,0,1,0,0|1,1,0]=4 1010 B22R2.4515581 Cc1ncsc1CCOC2CCCCCCCCCCC2 1f95ee7f7a9b6ecbc2c14b24fc748e9e [0,1,0,1,0,0|1,0,1]=4 1011 B22R2.37825266 CCCCCCCCCC(=O)N1CCc2c(ncn2C)C1 631e548480aeef0cc97d2659d53f54dd [0,1,0,1,0,0|2,0,0]=4 1012 B22R2.519248 Cc1ncsc1CCNC(=O)CCCC2CCN(CC2)C 140280c5205fbbfcb9b923d5717e0746 [0,1,0,1,0,0|2,0,0]=4 1013 B22R2.519248 Cc1ncsc1CCNC(=O)NCCC2CCC(CC2)O 5775dfd30822b0f9f0e70a2bf5526b1e [0,1,0,1,0,0|2,0,0]=4 1014 B22R2.558021 CCC(C)CCCCCCC(=O)N1CCc2sccc2C1 289be44202012b077861472ec2e71761 [0,1,0,1,0,0|2,0,0]=4 1015 B22R2.558021 CCC(C)CCCCCCC(=O)N1CCc2scnc2C1 07b9a5956cfbba4bbae8086c9770673d [0,1,0,1,0,0|1,0,0]=3 1016 B22R2.696819 CCCCC(=O)CCCCC(=O)N1CCc2scnc2C1 65a2eeb0392a6905f88825511d54d43a [0,1,0,1,0,0|1,0,1]=4 1017 B22R2.754623 CCCCCC(=O)CCCC(=O)N1CCc2scnc2C1 0a544366124a7704f4b4f16932d87397 [0,1,0,1,0,0|1,0,1]=4 1018 B22R2.754623 CCCCCC(O)CCCC(=O)N1CCc2sccc2C1 a1eabb7dac6ea08f536cf334bfe5480c [0,1,0,1,0,0|2,0,0]=4 1019 B22R2.754623 CCCCCC(O)CCCC(=O)N1CCc2scnc2C1 222df2dbd0555850a53c2a34bf5ef3d4 [0,1,0,1,0,0|1,0,0]=3 1020 B22R2.4112604 Cc1ncsc1CCNC(=O)CCN2C(CCCC2C)C 9b0217950d51347f4f96e5425eaf7197 [0,1,0,1,0,0|2,0,0]=4 1021 B22R2.4514273 Cc1ncsc1CCNC(=O)NCCC2(CCCCC2)O 2d882c7792b247b25ff3557578d6bef5 [0,1,0,1,0,0|2,0,0]=4 1022 B22R2.200607 Cc1ncsc1CCNC(=O)N(C)CCC2CCCCC2 c8ca09874b1b684002c8fa0d2ddccefa [0,1,0,1,0,0|2,0,0]=4 1023 B22R2.690261 CCCCCCCCC(O)C(=O)N1CCc2sccc2C1 98b4a7c58ac503685b0e896ea9625ab5 [0,1,0,1,0,0|2,0,0]=4 1024 B22R2.690261 CCCCCCCCC(O)C(=O)N1CCc2scnc2C1 983827534328aef0417f8159d49fa4f5 [0,1,0,1,0,0|1,0,0]=3 1025 B22R2.690261 CCCCCCCOC(C)C(=O)N1CCc2scnc2C1 e02a83e5fb830cb1e27597487a8d04c5 [0,1,0,1,0,0|2,0,0]=4 1026 B22R2.4516371 Cc1ncsc1CCNC(=O)N(C)CC2CCCCCC2 aa9a1808f76cf5e1ee05ee6e3407dd86 [0,1,0,1,0,0|2,0,0]=4 1027 B22R2.200614 Cc1ncsc1CCNC(=O)NCC(O)C2CCCCC2 0932e202f1dd5de744cc6f6bcff40900 [0,1,0,1,0,0|2,0,0]=4 1028 B22R2.689555 CCCCCCC(=O)CCC(=O)N1CCc2scnc2C1 2b10cba96b8ac5d93edc5a7fa349404c [0,1,0,1,0,0|1,0,1]=4 1029 B22R2.4112592 Cc1ncsc1CCNC(=O)NCC2(CCCCCC2)O 4c879665d66431aa3d43ef2b56eb3068 [0,1,0,1,0,0|2,0,0]=4 1030 B22R2.9144 Cc1ncsc1CCNC(=O)NC(C)CC2CCCCC2 f7536cd40a4b4a0cda1a7c53ceeba71b [0,1,0,1,0,0|2,0,0]=4 1031 B22R2.201597 Cc1ncsc1CCNC(=O)CC(C)N2CCCCC2C 55e4fe9684b321df4fdc5242bd13e064 [0,1,0,1,0,0|2,0,0]=4 1032 B22R2.563296 CCCCCCCC(O)CC(=O)N1CCc2sccc2C1 7b861f2bf7d642960af1bed1228ba74e [0,1,0,1,0,0|2,0,0]=4 1033 B22R2.563296 CCCCCCCC(O)CC(=O)N1CCc2scnc2C1 ddab870b622ded594a0223916f583a7c [0,1,0,1,0,0|1,0,0]=3 1034 B22R2.563296 CCCCCCC[C@@H](O)CC(=O)N1CCc2sccc2C1 3f4c5c409ce826eb80a7b2dbafe049e4 [0,1,0,1,0,0|2,0,0]=4 1035 B22R2.563296 CCCCCCC[C@@H](O)CC(=O)N1CCc2scnc2C1 0b48b7cea1d04f6172409bfebf730579 [0,1,0,1,0,0|1,0,0]=3 1036 B22R2.563296 CCCCCCC[C@H](C)NC(=O)N1CCc2scnc2C1 c34cb19a66328bfde7e4950585d92462 [0,1,0,1,0,0|2,0,0]=4 1037 B22R2.4513371 Cc1ncsc1CCNC(=O)CC(C)N2CCCCCC2 f24b1dc4b00941a22e95111d389d1f05 [0,1,0,1,0,0|2,0,0]=4 1038 B22R2.471651 CCCCC1CCCN1C(=O)NCCc2sc(nc2C)C 48868a3ca00776217aaafe01df653930 [0,1,0,1,0,0|2,0,0]=4 1039 B22R2.1306129 CCC1CCCCN1CC(=O)NCCc2sc(nc2C)C b4b335a42dd1387f19e5b00c4eb0432b [0,1,0,1,0,0|2,0,0]=4 1040 B22R2.2811177 CCCN1CCCCC1C(=O)NCCc2sc(nc2C)C e680dee324d33fd79433337613dd44a5 [0,1,0,1,0,0|2,0,0]=4 1041 B22R2.3963572 Cc1nc(c(s1)CCNC(=O)CCCC2CCCCC2)C 59705f5861cc8dcf1fac20b2514d191c [0,1,0,1,0,0|1,0,0]=3 1042 B22R2.3963572 Cc1nc(c(s1)CCNC(=O)CCCN2CCCCC2)C caadb8cc7898bc29098f37de8ba4555b [0,1,0,1,0,0|2,0,0]=4 1043 B22R2.4579731 Cc1nc(c(s1)CCNC(=O)CCN2CCCCC2C)C d52f96feb67f24c0fc9f6be173920a05 [0,1,0,1,0,0|2,0,0]=4 1044 B22R2.4579731 Cc1nc(c(s1)CCNC(=O)COC2CCCCC2C)C 02dc8faaab446ad1ae2d3f1a6ce138bd [0,1,0,1,0,0|2,0,0]=4 1045 B22R2.4579731 Cc1nc(c(s1)CCNC(=O)NCC2CCCCC2C)C 0cf904285cf9f0ec132b2c271e85de86 [0,1,0,1,0,0|2,0,0]=4 1046 B22R2.6949545 CCCCCCCCCC(=O)N1CCc2oc(nc2C1)C 4a46f8cae9ee38fc3f0f7d397a571d52 [0,1,0,1,0,0|1,1,0]=4 1047 B22R2.6949545 CCCCCCCCCC(=O)N1CCc2sc(cc2C1)Br 45935ae1381c90e9246b5d16b7220e79 [0,1,0,1,0,0|2,0,0]=4 1048 B22R2.19829294 Cc1nc(c(s1)CCNC(=O)N2CCCCCCCC2)C 8f6182029d5bf2d44f0d485b169df834 [0,1,0,1,0,0|2,0,0]=4 1049 B22R2.19830917 Cc1nc(c(s1)CCNC(=O)CN2CCCCCCC2)C c4fbb88dfb82f51b820a64b17eadb5de [0,1,0,1,0,0|2,0,0]=4 1050 B22R2.31195531 Cc1nc(c(s1)CCNC(=O)CCN2CCCCCC2)C 56285a6268e5d8d36475e4c06f81c776 [0,1,0,1,0,0|2,0,0]=4 1051 B22R2.31195531 Cc1nc(c(s1)CCNC(=O)NCC2CCCCCC2)C 05a78186314ecd3c003ba8651f322445 [0,1,0,1,0,0|2,0,0]=4 1052 B22R3.789416 O=C(CCCC1CCCCC1)N2CCc3sccc3C2 dff5df4faf41a68bb863c3705f515761 [0,0,0,2,0,0|2,0,0]=4 1053 B22R3.789416 O=C(CCCC1CCCCC1)N2CCc3scnc3C2 d41c49549a16f89c0f3154929fc7c181 [0,0,0,2,0,0|1,0,0]=3 1054 B22R3.789416 O=C(CCCN1CCCCC1)N2CCc3scnc3C2 e07a53872aa35d4c2dfa08a4013d1a21 [0,0,0,2,0,0|2,0,0]=4 1055 B22R3.789416 O=C(NCCC1CCCCC1)N2CCc3scnc3C2 d8c23dea31cac984865b3ff820d455bb [0,0,0,2,0,0|2,0,0]=4 1056 B22R3.120485 CCC1CCCCN1CC(=O)N2CCc3scnc3C2 b0b60fcaa09edd9f47acb323a23f0a97 [0,0,0,2,0,0|2,0,0]=4 1057 B22R3.265375 Cc1ncsc1CCNC(=O)NC2CCCCC23CC3 daa3ab793b70d8c56ff918f705c76651 [0,0,0,2,0,0|2,0,0]=4 1058 B22R3.265371 Cc1ncsc1CCNC(=O)N2CC[C@H]3CCC[C@H]3C2 44100a626191e0627e1e9e6d4eb61a38 [0,0,0,2,0,0|2,0,0]=4 1059 B22R3.266327 Cc1ncsc1CCNC(=O)N[C@@H]2CC[C@@H]3[C@H]2CCC3 b25d07303fd91d43b3b4254de14dcd23 [0,0,0,2,0,0|2,0,0]=4 1060 B22R3.266327 Cc1ncsc1CCNC(=O)N[C@H]2CC[C@H]3[C@@H]2CCC3 de0d9c634eacafedad089f6b3177b59c [0,0,0,2,0,0|2,0,0]=4 1061 B22R3.6448231 Cc1ncsc1CCNC(=O)CCN2CC3CCC2C3 9da03b2d6bc9101b511a62ecf6e8ebf8 [0,0,0,2,0,0|2,0,0]=4 1062 B22R3.253244 CC1CCCCC1CNC(=O)N2CCc3scnc3C2 1cb6efdf3654c5a6683149bf54a881c1 [0,0,0,2,0,0|2,0,0]=4 1063 B22R3.253244 CC1CCCCC1OCC(=O)N2CCc3scnc3C2 e6a9bc74f920b1ae15d23eb1f8734e82 [0,0,0,2,0,0|2,0,0]=4 1064 B22R3.253244 CC1CCCCN1CCC(=O)N2CCc3scnc3C2 c261fc8f4323cc6370bdb5ab2cb54669 [0,0,0,2,0,0|2,0,0]=4 1065 B22R3.5779477 Cc1ncsc1CCNC(=O)N2CC3CCCCC3C2 88493a6819236285c8d2fd2ab2ea95f0 [0,0,0,2,0,0|2,0,0]=4 1066 B22R3.5779477 Cc1ncsc1CCNC(=O)N2C[C@H]3CCCC[C@H]3C2 1cb2183f31fd159961e779b993756468 [0,0,0,2,0,0|2,0,0]=4 1067 B22R3.265344 Cc1ncsc1CCNC(=O)C2CCN2C3CCCC3 b44aab9b8a8d734d59e6d94528041a78 [0,0,0,2,0,0|2,0,0]=4 1068 B22R3.5788738 Cc1ncsc1CCNC(=O)NC2CCC23CCCC3 7e70ca7282792fc5434ce3fb91c2b567 [0,0,0,2,0,0|2,0,0]=4 1069 B22R3.12500431 O=C(NCCCC1CCCC1)N2CCc3scnc3C2 8bf1d153664740cf6e8b2a1ac7eedf9e [0,0,0,2,0,0|2,0,0]=4 1070 B22R3.814544 CCCN1CCCCC1C(=O)N2CCc3scnc3C2 772e42f0aa08246c808eac62be6c6953 [0,0,0,2,0,0|2,0,0]=4 1071 B22R3.5779485 Cc1ncsc1CCNC(=O)N2[C@H]3CCC[C@@H]2CCC3 2c22ec16905251a51ff730acf23959ab [0,0,0,2,0,0|2,0,0]=4 1072 B22R3.5788737 Cc1ncsc1CCNC(=O)CC23CCCN2CCC3 8d295c32b714d778b610ccbcce796994 [0,0,0,2,0,0|2,0,0]=4 1073 B22R3.12499393 O=C(CN1CCCCCCC1)N2CCc3scnc3C2 19397e72061ce33d96db3dd3aaab9b8c [0,0,0,2,0,0|2,0,0]=4 1074 B22R3.12499393 O=C(NC1CCCCCCC1)N2CCc3scnc3C2 305118f23961ecafbfa4826bb146aff9 [0,0,0,2,0,0|2,0,0]=4 1075 B22R3.12526548 O=C(CCN1CCCCCC1)N2CCc3scnc3C2 7f3e50e00bbf9f7a8b724f30afcc347d [0,0,0,2,0,0|2,0,0]=4 1076 B22R3.12526548 O=C(NCC1CCCCCC1)N2CCc3scnc3C2 c3f7e964fdf75a492d2f394f329ec20d [0,0,0,2,0,0|2,0,0]=4 1077 B22R3.265350 Cc1ncsc1CCNC(=O)[C@@H]2CCCN2CC3CC3 95295804fce793eb040f6c9c621a35a9 [0,0,0,2,0,0|2,0,0]=4 1078 B18R1.346 CCCCCCCCCC(=O)NCc1cccs1 675bf31dade04a221fdde6e124281b4a [1,0,0,0,1,0|2,0,0]=4 1079 B18R1.346 CCCCCCCCCC(=O)NCc1cnco1 0e682d4815e092a2ff9cc6e14ab627b7 [1,0,0,0,1,0|1,1,0]=4 1080 B18R1.346 CCCCCCCCCC(=O)NCc1cncs1 9167fe17bab32fb5c5695ec1955b484f [1,0,0,0,1,0|1,0,0]=3 1081 B18R1.346 CCCCCCCCNC(=O)CCc1cccs1 b3f7dbe201f39b8d697b5a24cf729916 [1,0,0,0,1,0|2,0,0]=4 1082 B18R1.346 CCCCCCCCNC(=O)CCc1cncs1 b5744cdaf34fbb3c8047a94c9b20a489 [1,0,0,0,1,0|1,0,0]=3 1083 B18R1.346 CCCCCCCCNC(=O)NCc1cncs1 8009dd419a533f84cc50a4c65e817280 [1,0,0,0,1,0|2,0,0]=4 1084 B18R1.346 CCCCOCCCNC(=O)CCc1cncs1 4135dc053591ac01d24793cf35f2e45f [1,0,0,0,1,0|2,0,0]=4 1085 B18R1.346 CCCSCCCCNC(=O)CCc1cncs1 2e555835e39f2572730d704a52ae0d86 [1,0,0,0,1,0|2,0,0]=4 1086 B18R1.346 O=C(CCCCCCCCO)NCc1cncs1 8aec9801270feef6eec3546f6f83eca5 [1,0,0,0,1,0|2,0,0]=4 1087 B18R1.346 O=C(CCCCCCCCS)NCc1cncs1 5ae8498d509709c69d93086e01a585d3 [1,0,0,0,1,0|2,0,0]=4 1088 B18R1.346 O=C(CCc1cncs1)NCCCCCCCO b0594f6424aa6acb2eecd25abdb17414 [1,0,0,0,1,0|2,0,0]=4 1089 B18R1.7813 CCCCCCCCC(=O)NCc1scnc1Br c54d16bd87dd255d864f7f5dc6baf711 [1,0,0,0,1,0|2,0,0]=4 1090 B18R1.7813 CCCCCCCCC(=O)NCc1scnc1C acc3e23509d8b0e66f02d4c46ad388b1 [1,0,0,0,1,0|1,0,0]=3 1091 B18R1.7813 CCCCCCCCC(=O)NCc1snnc1C 40e0eb39e1dc7290cd3c912dab3ddede [1,0,0,0,1,0|2,0,0]=4 1092 B18R1.7813 CCCCCCCNC(=O)CCc1sccc1C bcf2f51bebf5321940c16ae70ddd439b [1,0,0,0,1,0|2,0,0]=4 1093 B18R1.7813 CCCCCCCNC(=O)CCc1scnc1C 61e47511366e6505a5b7049cc48512f5 [1,0,0,0,1,0|1,0,0]=3 1094 B18R1.7813 CCCCCCCNC(=O)NCc1scnc1C 62b62103db2e293fe30d50bea0ad4493 [1,0,0,0,1,0|2,0,0]=4 1095 B18R1.7813 CCCCOCCNC(=O)CCc1scnc1C ca724cda1244a3cb1d595cbb9492968c [1,0,0,0,1,0|2,0,0]=4 1096 B18R1.7813 CCCOCCCNC(=O)CCc1scnc1C 10b0d76c08059e89e7d177726f5f6809 [1,0,0,0,1,0|2,0,0]=4 1097 B18R1.7813 CCSCCCCNC(=O)CCc1scnc1C 4501a352f2cc01ac0ebe451918597f4a [1,0,0,0,1,0|2,0,0]=4 1098 B18R1.7813 COCCCCCNC(=O)CCc1scnc1C f3182ef34b98498b7e4fd7016031201a [1,0,0,0,1,0|2,0,0]=4 1099 B18R1.7813 CSCCCCCCC(=O)NCc1scnc1C 61b6a62ea66f79fc7963738ca20260ce [1,0,0,0,1,0|2,0,0]=4 1100 B18R1.7813 Cc1ncsc1CCC(=O)NCCCCCCCl a067d916b176499c3da68be66bcaa0a3 [1,0,0,0,1,0|2,0,0]=4 1101 B18R1.7813 Cc1ncsc1CCC(=O)NCCCCCCO ed495c90bf4d900a2e4ecb30a41bd173 [1,0,0,0,1,0|2,0,0]=4 1102 B18R1.7813 Cc1ncsc1CNC(=O)CCCCCCCF 2d3302958d1817654254713b0173b52e [1,0,0,0,1,0|2,0,0]=4 1103 B18R1.7813 Cc1ncsc1CNC(=O)CCCCCCCO 6368114e5530a76d284841b05faaf19d [1,0,0,0,1,0|2,0,0]=4 1104 B18R1.7813 Cc1ncsc1CNC(=O)CCCCCCCS 3a857bf3a8fa6e07bad35022498abb54 [1,0,0,0,1,0|2,0,0]=4 1105 B18R1.24272 CCCCCCCCCC(=O)Nc1scnc1C 01d938a9572708545ddc6a9c0803c741 [0,0,0,0,2,0|1,0,0]=3 1106 B18R1.24272 CCCCCCCCCN(C)Cc1scnc1C f13b4f79e4fd8709fe757c501d22cf4a [0,0,0,0,2,0|2,0,0]=4 1107 B18R1.24272 CCCCCCCCNC(=O)Cc1sccc1C f428191d2333308160a683438dc96e1a [0,0,0,0,2,0|2,0,0]=4 1108 B18R1.24272 CCCCCCCCNC(=O)Cc1scnc1C fbe325a5ae50818c5e0b021422e430bd [0,0,0,0,2,0|1,0,0]=3 1109 B18R1.24272 CCCCOCCCNC(=O)Cc1scnc1C b14cad73cecc68dddbec6a92ee8763e0 [0,0,0,0,2,0|2,0,0]=4 1110 B18R1.24272 CCCSCCCCNC(=O)Cc1scnc1C fc51e925572de32472e14e658591e4a4 [0,0,0,0,2,0|2,0,0]=4 1111 B18R1.24272 Cc1ncsc1CC(=O)NCCCCCCCO 8d5587dba3eb170fa86d5d366245a619 [0,0,0,0,2,0|2,0,0]=4 1112 B18R1.24272 Cc1ncsc1NC(=O)CCCCCCCCO dafbd9b7f6d7500e62037c87779b731c [0,0,0,0,2,0|2,0,0]=4 1113 B18R1.24272 Cc1ncsc1NC(=O)CCCCCCCCS e6d9fce51ca1d6e633c46960c2939dc4 [0,0,0,0,2,0|2,0,0]=4 1114 B20R1.57986 CCCCCCCCCCOCCc1ccncc1C 1ad920d15f898c5b4e927058ad30cf54 [1,0,0,0,0,1|1,0,1]=4 1115 B20R1.57986 CCCCCCCCCCOCCc1nccnc1C 94e67bb7e82a8e134be4e44fd5b6e54a [1,0,0,0,0,1|1,0,1]=4 1116 B20R1.32622 CCCCCCCCC(=O)NCCc1ccnc(c1)C 27896e2ef4efa099ea7eedcf38b32fc6 [1,0,0,0,0,1|2,0,0]=4 1117 B20R1.60379 CCCCCCCCC(=O)OCOc1cccnc1C 1623631f1331e98d5540cd289818cfd9 [1,0,0,0,0,1|2,0,0]=4 1118 B20R1.60379 CCCCCCCCC(=O)OCOc1nccnc1C 7115596bb8dc5f24e27d57f466faa9c2 [1,0,0,0,0,1|2,0,0]=4 1119 B22R1.20319 CCCCCCCCCC(=O)OCNCc1cccnc1C 26ff5f6ec5c00e3a89f309d12b1cfbf7 [0,0,0,0,0,2|1,0,0]=3 1120 B22R1.20319 CCCCCCCCCC(=O)OCNCc1ccncc1Br 6ecc05f91de2520f26c064b84212d962 [0,0,0,0,0,2|2,0,0]=4 1121 B22R1.20319 CCCCCCCCCC(=O)OCNCc1ccncc1Cl 7c46aaef398aeda90bee61b1ff755d8a [0,0,0,0,0,2|2,0,0]=4 1122 B22R1.20319 CCCCCCCCCC(=O)OCNCc1nccnc1Cl d23a42d23d4ee5f03d395783e963b379 [0,0,0,0,0,2|2,0,0]=4 1123 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cccnc1Br b69c55311a53cf52683b8b52546de072 [0,0,0,0,0,2|2,0,0]=4 1124 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cccnc1C 38a19d4a290c8d4d742d4589306a7fa4 [0,0,0,0,0,2|1,0,0]=3 1125 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cccnc1Cl 455a2cdee2c907db0c162b8eba3eaa21 [0,0,0,0,0,2|2,0,0]=4 1126 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cccnc1F 232ead70155fa0a84cd2f96c797c3d22 [0,0,0,0,0,2|2,0,0]=4 1127 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccncc1Br ec8820bbfa3cf0ec363a666a5d0ebd83 [0,0,0,0,0,2|2,0,0]=4 1128 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccncc1C a7eb2032c85a4ebf73cf55cdd72be99c [0,0,0,0,0,2|1,0,0]=3 1129 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccncc1Cl 2364bc777e2f4c750eee07ff373e5c8d [0,0,0,0,0,2|2,0,0]=4 1130 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccncc1F 8555781b0f2c0fd327bcf8238891d31d [0,0,0,0,0,2|2,0,0]=4 1131 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccncc1I 1317862018b9f5731dcefcc70cc4009b [0,0,0,0,0,2|2,0,0]=4 1132 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ccnnc1C 5d7e0644003722cb16f02106e3612cdf [0,0,0,0,0,2|1,0,0]=3 1133 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cncnc1Cl 45ecf83cfe602a0cdbe2ff2c9827b4ea [0,0,0,0,0,2|2,0,0]=4 1134 B22R1.20319 CCCCCCCCCC(=O)OCOCc1cnncc1C b41a1c78210298372746d7e2f0b0c9e6 [0,0,0,0,0,2|2,0,0]=4 1135 B22R1.20319 CCCCCCCCCC(=O)OCOCc1ncccc1C 86aebe12a3f36bd4bee8375948d32d93 [0,0,0,0,0,2|2,0,0]=4 1136 B22R1.20319 CCCCCCCCCC(=O)OCOCc1nccnc1C 32971c64d23e56998097991800d5610f [0,0,0,0,0,2|1,0,0]=3 1137 B22R1.20319 CCCCCCCCCC(=O)OCOCc1nccnc1Cl aa9fb7aa175568384c535447019e97a1 [0,0,0,0,0,2|2,0,0]=4 1138 B22R1.20319 CCCCCCCCCC(=O)OCOCc1nnccc1C dbec9cb3f9eb0a064576bce66cdd886a [0,0,0,0,0,2|2,0,0]=4 1139 B22R1.42505 CCCCCCCCCC(=O)OCNCc1cc(ccn1)C 80a52fdb35907a264bf85769a06ebe76 [0,0,0,0,0,2|2,0,0]=4 1140 B22R1.42505 CCCCCCCCCC(=O)OCNCc1cccc(c1)C 862e25a07228836925e51d7ca274a440 [0,0,0,0,0,2|2,0,0]=4 1141 B22R1.42505 CCCCCCCCCC(=O)OCNCc1cccc(n1)C a3001e3754f0f9e9b619a148c7c11c12 [0,0,0,0,0,2|2,0,0]=4 1142 B22R1.42505 CCCCCCCCCC(=O)OCNCc1ccnc(c1)Cl 48a4ee85ed39aa124417b1b32de57acb [0,0,0,0,0,2|2,0,0]=4 1143 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cc(ccn1)C 904ad683fee06703cd8873b3489c3553 [0,0,0,0,0,2|2,0,0]=4 1144 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cc(ncn1)C e60213dea87711c73aba50422e6c144a [0,0,0,0,0,2|1,0,0]=3 1145 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cc(ncn1)Cl 4c07ac1c5c3b4a14ea51ee25df1b9865 [0,0,0,0,0,2|2,0,0]=4 1146 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cccc(c1)C 52b46b05f728002027c6205bc6f56069 [0,0,0,0,0,2|2,0,0]=4 1147 B22R1.42505 CCCCCCCCCC(=O)OCOCc1cccc(n1)C a92c4474d37509090ee47ca0cdf7f0fb [0,0,0,0,0,2|2,0,0]=4 1148 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(=O)[nH]1 6d1aa7098ce361843d2128c48d4d81e2 [0,0,0,0,0,2|2,0,0]=4 1149 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(c1)Br dfb380187f9f94d788786b6ce2f374dd [0,0,0,0,0,2|2,0,0]=4 1150 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(c1)C f832a55d965257706dd51157b55999e2 [0,0,0,0,0,2|1,0,0]=3 1151 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(c1)Cl cbf454f86a5aee8de46b66dd6f519608 [0,0,0,0,0,2|2,0,0]=4 1152 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(c1)F ef0f26e4b0dd089569664e6ee32bba04 [0,0,0,0,0,2|2,0,0]=4 1153 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(n1)C 25f500b21e093d1b85044faa191422ea [0,0,0,0,0,2|1,0,0]=3 1154 B22R1.42505 CCCCCCCCCC(=O)OCOCc1ccnc(n1)Cl e634bad256609380d2d1f5a582ec952b [0,0,0,0,0,2|2,0,0]=4 1155 B22R1.42505 CCCCCCCCCC(=O)OCOCc1nccc(n1)C 0c68e4fa720d64514eac6e93aa394b7a [0,0,0,0,0,2|2,0,0]=4 1156 B22R1.1399595 CCCCCCCCCC(=O)OCNCCc1ccnn1C a41ca000a7a18d357c2be2fd3ba75a8a [0,0,0,0,0,2|2,0,0]=4 1157 B22R1.1399595 CCCCCCCCCC(=O)OCOCCn1ccnc1C 8aaa6eb48ba7feda6c72b55fabbff050 [0,0,0,0,0,2|2,0,0]=4