0 B16R2.685 C=CC(Nc1ccco1)c2ccccc2 9a9c628ba3588d7f4f353a8d867d30e8 [0,0,0,0,0,0|2,0,1]=3 1 B16R2.685 C=CC(Nc1cccs1)c2ccccc2 e8b8d6a31d06c6a6adc34b7416d6cc48 [0,0,0,0,0,0|2,1,1]=4 2 B16R2.685 C=CC(Nc1ccno1)c2ccccc2 9840d3a958b4f42bfae54f03f91d2bc3 [0,0,0,0,0,0|3,0,1]=4 3 B16R2.685 C=CC(Nc1ncco1)c2ccccc2 d0e315a2be69decb3ed5810901e26304 [0,0,0,0,0,0|3,0,1]=4 4 B16R2.685 C=CC(Oc1ccco1)c2ccccc2 81ae812bcc6148cb41e665b1a4d60395 [0,0,0,0,0,0|2,0,1]=3 5 B16R2.685 C=CC(Oc1cccs1)c2ccccc2 758b4942ec005aba3e6d415f0d01b89c [0,0,0,0,0,0|2,1,1]=4 6 B16R2.685 C=C[C@@H](Nc1ccco1)c2ccccc2 5fcf1a98ed42eeaa7329a7cd805d6220 [0,0,0,0,0,0|2,0,1]=3 7 B16R2.685 C=C[C@@H](Nc1cccs1)c2ccccc2 8ee1623a586cda46647c58a0b26b04b8 [0,0,0,0,0,0|2,1,1]=4 8 B16R2.685 C=C[C@@H](Nc1ccno1)c2ccccc2 a003dabcf6651342af10338c3eaab2d8 [0,0,0,0,0,0|3,0,1]=4 9 B16R2.685 C=C[C@@H](Nc1ncco1)c2ccccc2 f4247a8dfc34ec76f53bfdb7417213f7 [0,0,0,0,0,0|3,0,1]=4 10 B16R2.685 C=C[C@H](Nc1ccco1)c2ccccc2 e13bf5efbe83f1fb6b8a9e21337f08ac [0,0,0,0,0,0|2,0,1]=3 11 B16R2.685 C=C[C@H](Nc1cccs1)c2ccccc2 1540cb11bfe8b0d702ed760edb18e1b7 [0,0,0,0,0,0|2,1,1]=4 12 B16R2.685 C=C[C@H](Nc1ccno1)c2ccccc2 f5e7f11c14feb459ab11c21f475cd6a9 [0,0,0,0,0,0|3,0,1]=4 13 B16R2.685 C=C[C@H](Nc1ncco1)c2ccccc2 2329694f51dfc19fd40f33e4fedbae1b [0,0,0,0,0,0|3,0,1]=4 14 B16R2.685 CCC(Oc1ccco1)c2ccccc2 daaae4329e5a3c7891c9f4a337697b40 [0,0,0,0,0,0|2,0,2]=4 15 B16R2.685 CCN(Cc1ccco1)c2ccccc2 3098b84896baea8f1eee8fee741ad959 [0,0,0,0,0,0|2,0,2]=4 16 B16R2.685 FCN(Cc1ccco1)c2ccccc2 ddcc956ab5c16348b842df953cf5aa8d [0,0,0,0,0,0|2,0,2]=4 17 B16R2.685 N#CN(Cc1ccco1)c2ccccc2 7e43585496e77dad2bf1209a6692b11a [0,0,0,0,0,0|2,0,2]=4 18 B16R2.685 O=CC(Nc1cc[nH]n1)c2ccccc2 c092bd2f6f15a52743fa79c69010b479 [0,0,0,0,0,0|3,0,1]=4 19 B16R2.685 O=CC(Nc1cccs1)c2ccccc2 5bdf83100851cddca9d530ed01334152 [0,0,0,0,0,0|1,1,1]=3 20 B16R2.685 O=CC(Nc1ccno1)c2ccccc2 927fe5dfbf7e369b24133091a6f10390 [0,0,0,0,0,0|2,0,1]=3 21 B16R2.685 O=CC(Nc1ccns1)c2ccccc2 8db44fbf301a41db3d01e7a8ac689fb9 [0,0,0,0,0,0|2,1,1]=4 22 B16R2.685 O=CC(Nc1ccon1)c2ccccc2 0eda7fd76a127b74d448fe08988a86c4 [0,0,0,0,0,0|3,0,1]=4 23 B16R2.685 O=CC(Nc1ccsc1)c2ccccc2 67fcb7e0f764b35c6426a913eaacb358 [0,0,0,0,0,0|3,0,1]=4 24 B16R2.685 O=CC(Nc1cncs1)c2ccccc2 01965413d4c9edfe8cc8f49054a57371 [0,0,0,0,0,0|2,1,1]=4 25 B16R2.685 O=CC(Nc1cocn1)c2ccccc2 1eb8ddd6b440fc53867d4423e484868a [0,0,0,0,0,0|3,0,1]=4 26 B16R2.685 O=CC(Nc1cscn1)c2ccccc2 c13c09c226d139dfa866493561bfef1d [0,0,0,0,0,0|3,0,1]=4 27 B16R2.685 O=CC(Nc1ncc[nH]1)c2ccccc2 e7173d39018f7a34bc294ade7dc377bd [0,0,0,0,0,0|3,0,1]=4 28 B16R2.685 O=CC(Nc1ncco1)c2ccccc2 b07479ee6f7153304a9c4863d3679f86 [0,0,0,0,0,0|2,0,1]=3 29 B16R2.685 O=CC(Nc1nccs1)c2ccccc2 c099de0ba42079ddd00bc3584b2de425 [0,0,0,0,0,0|2,1,1]=4 30 B16R2.685 O=CC(Nc1nnco1)c2ccccc2 34dec1758c2281ac81ae550a6a2fc159 [0,0,0,0,0,0|3,0,1]=4 31 B16R2.685 O=CC(Oc1c[nH]cn1)c2ccccc2 1f714523160b82e55ba63cae75d52abd [0,0,0,0,0,0|3,0,1]=4 32 B16R2.685 O=CC(Oc1ccco1)c2ccccc2 6244678866fc17836060b0b27f2abb87 [0,0,0,0,0,0|1,0,1]=2 33 B16R2.685 O=CC(Oc1cccs1)c2ccccc2 3576805cf7295a7d872f9ef8eab2e5ba [0,0,0,0,0,0|1,1,1]=3 34 B16R2.685 O=CC(Oc1ccn[nH]1)c2ccccc2 20467670be3484b44240407d345160fa [0,0,0,0,0,0|3,0,1]=4 35 B16R2.685 O=CC(Oc1ccsc1)c2ccccc2 8ec967bb9070d455e1990ca92f2231ed [0,0,0,0,0,0|3,0,1]=4 36 B16R2.685 O=CC(Oc1nccs1)c2ccccc2 e463369517a4d6df3135a705a4e207de [0,0,0,0,0,0|2,1,1]=4 37 B16R2.685 O=CC(On1cccn1)c2ccccc2 b512d3c8388253039544cca81744efe6 [0,0,0,0,0,0|3,0,1]=4 38 B16R2.685 O=CN(Cc1ccco1)c2ccccc2 202cb978994a3e3c4661bc8f2d6f1f63 [0,0,0,0,0,0|1,0,1]=2 39 B16R2.685 O=CN(Cc1cccs1)c2ccccn2 a35de547c7d0fccaea4628fb958ef101 [0,0,0,0,0,0|2,1,1]=4 40 B16R2.685 OCN(Cc1ccco1)c2ccccc2 cab3ab9c3269fcf7a613a153923dceb6 [0,0,0,0,0,0|1,0,3]=4 41 B15R2.1259 CN(Cc1ccco1)c2ccccc2 468e54485d3a2d5472c5016e569f423e [1,0,0,0,0,0|1,0,2]=4 42 B15R2.1259 O=C(Nc1cccs1)c2ccccc2 012bdd447192c50024bbe05f8f5bd07e [1,0,0,0,0,0|1,1,0]=3 43 B15R2.1259 O=C(Nc1cccs1)c2ccccn2 3f55d4ed7aebf781e90ab35ecdc11309 [1,0,0,0,0,0|2,1,0]=4 44 B15R2.1259 O=C(Nc1cccs1)c2cccnc2 95cef70d586e12a18b18864e7ac91636 [1,0,0,0,0,0|2,1,0]=4 45 B15R2.1259 O=C(Nc1cccs1)c2ccncc2 5925f73c904eeca5f62b119d5da6eec6 [1,0,0,0,0,0|2,1,0]=4 46 B15R2.1259 O=C(Nc1ccno1)c2ccccc2 9b33956da61387e4c7b22ce6f9837f90 [1,0,0,0,0,0|2,0,0]=3 47 B15R2.1259 O=C(Nc1ccno1)c2ccccn2 47ba6288b3ce1dee706de98771cec82a [1,0,0,0,0,0|3,0,0]=4 48 B15R2.1259 O=C(Nc1ccno1)c2cccnc2 4a322a3a3474d68c92a5601702a52aa5 [1,0,0,0,0,0|3,0,0]=4 49 B15R2.1259 O=C(Nc1ccno1)c2ccncc2 55f8ee07001b0483ab9363c2f6f689f2 [1,0,0,0,0,0|3,0,0]=4 50 B15R2.1259 O=C(Nc1ccns1)c2ccccc2 434d66acd0e4f36142f9a5d26d7fc5a9 [1,0,0,0,0,0|2,1,0]=4 51 B15R2.1259 O=C(Nc1ccon1)c2ccccc2 70483897f464df82a5ee535ebc7387bf [1,0,0,0,0,0|3,0,0]=4 52 B15R2.1259 O=C(Nc1ccsc1)c2ccccc2 542cd67a77a0a4165bbf632ba77939f3 [1,0,0,0,0,0|3,0,0]=4 53 B15R2.1259 O=C(Nc1cncs1)c2ccccc2 770aacf96ebbcf09316fd8cec61e57e8 [1,0,0,0,0,0|2,1,0]=4 54 B15R2.1259 O=C(Nc1cocn1)c2ccccc2 e3f1be445fc13980b10455da2106deb5 [1,0,0,0,0,0|3,0,0]=4 55 B15R2.1259 O=C(Nc1cscn1)c2ccccc2 205963ce89e45d2ab6db5a49975526cf [1,0,0,0,0,0|3,0,0]=4 56 B15R2.1259 O=C(Nc1ncco1)c2ccccc2 f19efd97d541ede3f202bc103d39bdf1 [1,0,0,0,0,0|2,0,0]=3 57 B15R2.1259 O=C(Nc1ncco1)c2cccnc2 11e3cb296a4414050b0117a81120a7d9 [1,0,0,0,0,0|3,0,0]=4 58 B15R2.1259 O=C(Nc1ncco1)c2ccncc2 d2a958aff36fe0f0dddf355aac6224c3 [1,0,0,0,0,0|3,0,0]=4 59 B15R2.1259 O=C(Nc1nccs1)c2ccccc2 29ce287ef4d11e8d4aaa55b85fbc26ce [1,0,0,0,0,0|2,1,0]=4 60 B17R2.164 C=CC(Nc1ccco1)c2ccc(cc2)F 770072fd4576b8920479ee43ccf91a0b [0,1,0,0,0,0|2,0,1]=4 61 B17R2.164 Cc1ccc(cc1)N(C=O)Cc2ccco2 47e5f989e797e51e758b372c38a85c56 [0,1,0,0,0,0|1,0,1]=3 62 B17R2.164 Cc1ccc(cc1)N(C=O)Cc2cccs2 3439f3cedd7c0a431ae2735d657cc1ae [0,1,0,0,0,0|1,1,1]=4 63 B17R2.164 O=CN(Cc1ccco1)c2ccc(cc2)Cl ea2fa49a8cc538d87cbcc95323eb940a [0,1,0,0,0,0|1,0,1]=3 64 B17R2.164 O=CN(Cc1ccco1)c2ccc(cc2)O 2ad00ae22364a07003877da6e3e648c5 [0,1,0,0,0,0|1,0,1]=3 65 B17R2.164 O=CN(Cc1cccs1)c2ccc(cc2)Br 9ffd391b145d3eeac8d6f654767d923f [0,1,0,0,0,0|1,1,1]=4 66 B17R2.2192 C=CCN(Cc1ccco1)c2ccccc2 a4fb59836b34ca72fb735372b68075f6 [0,1,0,0,0,0|2,0,1]=4 67 B17R2.2192 C=CC[C@@H](Nc1ccco1)c2ccccc2 3bec5fd6c7abe3e5aca72ec4cf00c04f [0,1,0,0,0,0|2,0,1]=4 68 B17R2.2192 O=CCN(Cc1ccco1)c2ccccc2 3411c1946c559165c4a13524f005b640 [0,1,0,0,0,0|1,0,1]=3 69 B17R2.2293 CC(c1ccco1)N(C=O)c2ccccn2 127bf90ce77fafcbf1366b56983792bb [0,1,0,0,0,0|2,0,1]=4 70 B17R2.2293 CCN(C(=O)c1ccco1)c2ccccc2 499dbfdee7acc2294bfdc1e043e39347 [0,1,0,0,0,0|2,0,1]=4 71 B17R2.2293 CN(c1ncco1)C(C=O)c2ccccc2 92044c2ad56bac6fdac136510d19f80e [0,1,0,0,0,0|2,0,1]=4 72 B17R2.2293 N#CN(C(=O)c1ccco1)c2ccccc2 17819c0af64c95297c7e0ecb2b7cf29a [0,1,0,0,0,0|2,0,1]=4 73 B17R2.6039 C=CC(Nc1cc(co1)C)c2ccccc2 5855f37cadc2d1dab7cf76e4e12adbf3 [0,1,0,0,0,0|2,0,1]=4 74 B17R2.6039 C=CC(Nc1ccc(o1)C)c2ccccc2 23944d960230711f77fa27e542750a89 [0,1,0,0,0,0|2,0,1]=4 75 B17R2.6039 C=C[C@@H](Nc1cc(co1)C)c2ccccc2 dec25f62ea823f17645d7c6d15f2c69d [0,1,0,0,0,0|2,0,1]=4 76 B17R2.6039 C=C[C@@H](Nc1ccc(o1)C)c2ccccc2 06f45c52c3c9e074522ee170e8c57dbd [0,1,0,0,0,0|2,0,1]=4 77 B17R2.6039 C=C[C@H](Nc1cc(co1)C)c2ccccc2 cb8896ef55837121fad36e0c860fcd66 [0,1,0,0,0,0|2,0,1]=4 78 B17R2.6039 C=C[C@H](Nc1ccc(o1)C)c2ccccc2 438cf59ffceed081e33c2b45870749fc [0,1,0,0,0,0|2,0,1]=4 79 B17R2.6039 Cc1ccc(s1)NC(C=O)c2ccccc2 4dc96a0033df439e3a1f58fa4aa32e39 [0,1,0,0,0,0|1,1,1]=4 80 B17R2.6039 Cc1coc(n1)NC(C=O)c2ccccc2 6a2f6d2369598f9afb3618780047cca3 [0,1,0,0,0,0|2,0,1]=4 81 B17R2.6039 Cc1csc(c1)OC(C=O)c2ccccc2 4ea6540ecb84f5e0c9ab54eb0a475bd6 [0,1,0,0,0,0|1,1,1]=4 82 B17R2.6039 O=CC(Nc1cc(=O)[nH]o1)c2ccccc2 27892ddc58444ce736c3040b308851ac [0,1,0,0,0,0|2,0,1]=4 83 B17R2.6039 O=CC(Nc1ccc(s1)Br)c2ccccc2 9d63773f86ef0128b841bfe4693eefab [0,1,0,0,0,0|1,1,1]=4 84 B17R2.6039 O=CC(Nc1nc(co1)Br)c2ccccc2 098fb995199c339215be83c74f949363 [0,1,0,0,0,0|2,0,1]=4 85 B17R2.6039 O=CC(OC1C=CC(=O)O1)c2ccccc2 62c460b74fdb59ffa0d2a01be5c092bd [0,1,0,0,0,0|1,0,2]=4 86 B17R2.6039 O=CC(Oc1ccc(s1)Br)c2ccccc2 0325e165c894bd2dbcf19762188c9bcd [0,1,0,0,0,0|1,1,1]=4 87 B17R2.6046 O=CN(Cc1ccco1)c2cccc(c2)Cl 878fc03245dd41045faeeefbad0c6b0e [0,1,0,0,0,0|1,0,1]=3 88 B17R2.6046 O=CN(Cc1ccco1)c2cccc(c2)F 8bde1e4d18502d503dcfe97189b79954 [0,1,0,0,0,0|1,0,1]=3 89 B17R2.6057 Cn1cccc1OC(C=O)c2ccccc2 9cd230b0d3b277aad670d22cd92b4b52 [0,1,0,0,0,0|2,0,1]=4 90 B17R2.21294 CC(=O)C(Nc1cccs1)c2ccccc2 0d2106042a4b3edcb49036fda9168d79 [0,1,0,0,0,0|1,1,1]=4 91 B17R2.21294 CC(=O)C(Nc1ccno1)c2ccccc2 d76f881f58180479d41e485cad8f8410 [0,1,0,0,0,0|2,0,1]=4 92 B17R2.21294 CC(=O)C(Nc1ncco1)c2ccccc2 1489a395d1fbd6d8b243e6c2ff38bf3a [0,1,0,0,0,0|2,0,1]=4 93 B17R2.21294 CC(=O)N(Cc1ccco1)c2ccccc2 65b8232e1afbbe3ffc873feb48fa2720 [0,1,0,0,0,0|1,0,1]=3 94 B17R2.21294 NC(=O)C(Nc1ccco1)c2ccncc2 cc58dc0045d42d9a1f73063a0364c8c3 [0,1,0,0,0,0|2,0,1]=4 95 B17R2.21294 NC(=O)C(Nc1ccno1)c2ccccc2 437337b7c75e3cd88f27acc090feb41c [0,1,0,0,0,0|2,0,1]=4 96 B17R2.21294 O=C(O)C(Nc1ccno1)c2ccccc2 cb7f42749d2c742842378b74a977732b [0,1,0,0,0,0|2,0,1]=4 97 B17R2.21294 O=C(O)C(Nc1ncco1)c2ccccc2 c9c7ef02a4ed72682b053646761e1c78 [0,1,0,0,0,0|2,0,1]=4 98 B17R2.48520 O=CN(Cc1cccs1)c2ccccc2I 79bf5fdd58fbe07cfbf6f538a07cc7bd [0,1,0,0,0,0|1,1,1]=4 99 B15R1.33 C/C=C/CO/C=C(\C=O)/c1ccccc1 d7e299a834eb74aae2b1982b0dc3aec3 [0,0,1,0,0,0|2,0,1]=4 100 B15R1.33 C/C=C\CO/C=C(\C=O)/c1ccccc1 f31a13f03294c239a2f09096e8180ac4 [0,0,1,0,0,0|2,0,1]=4 101 B15R1.33 C=CCCO/C=C(\C=O)/c1ccccc1 8154692be46bb10e999799eb8428f3ad [0,0,1,0,0,0|2,0,1]=4 102 B15R1.33 O=C/C(=C\OC/C=C/Cl)/c1ccccc1 317c8133032e3fa64076bff86a7e4ee0 [0,0,1,0,0,0|2,0,1]=4 103 B15R1.33 O=C/C(=C\OC/C=C\Cl)/c1ccccc1 52db0fee9700f8031a0bf86d9db2e463 [0,0,1,0,0,0|2,0,1]=4 104 B17R3.1941 C1=Cc2cc(ccc2C1)c3ccccc3 10bbbf8c30a517cad01f30865f9b0220 [0,0,0,1,0,0|2,0,1]=4 105 B17R3.1941 C1=Cc2ccc(cc2C1)c3ccccc3 5a998f3bd74bd59b48ab5cff7d934490 [0,0,0,1,0,0|2,0,0]=3 106 B17R3.1941 C1=Cc2ccc(cc2C1)c3ccccn3 bda7afad4388fd86030fd8d28c7bee0a [0,0,0,1,0,0|3,0,0]=4 107 B17R3.1941 C1=Cc2ccc(cc2C1)c3cccnc3 a697e527a220053d3f28c5788d4706f2 [0,0,0,1,0,0|3,0,0]=4 108 B17R3.1941 C1=Cc2ccc(cc2C1)c3ccncc3 93783bd601a36dad3eaf554ec2f44f30 [0,0,0,1,0,0|3,0,0]=4 109 B17R3.1941 c1cc(ccn1)c2ccc3cc[nH]c3c2 f7f6386570944dc8d20e5b65b10da10e [0,0,0,1,0,0|3,0,0]=4 110 B17R3.1941 c1cc(ccn1)c2ccc3ccoc3c2 ed77b2224aeb63833fc3a953038cb62b [0,0,0,1,0,0|2,0,0]=3 111 B17R3.1941 c1cc(ccn1)c2ccc3ccoc3n2 f6f01bdc0b48469454e68bee93dcbefb [0,0,0,1,0,0|3,0,0]=4 112 B17R3.1941 c1cc(ccn1)c2ccc3ccsc3c2 999a634ba347cdb08137100b11ad82a4 [0,0,0,1,0,0|2,1,0]=4 113 B17R3.1941 c1cc(ccn1)c2ccc3cnoc3c2 c0fedcff1970599735b163bfca54057f [0,0,0,1,0,0|3,0,0]=4 114 B17R3.1941 c1cc(ccn1)c2ccc3ncoc3c2 97479590c1f5c8ff5d2fe9a97b1e09a8 [0,0,0,1,0,0|3,0,0]=4 115 B17R3.1941 c1cc(ccn1)c2cnc3cc[nH]c3c2 7076dee925bb2ec8d38516c6650f9abd [0,0,0,1,0,0|3,0,0]=4 116 B17R3.1941 c1cc(ccn1)c2cnc3ccoc3c2 73361ec3eb613eb0667eae8ff6473b99 [0,0,0,1,0,0|2,0,0]=3 117 B17R3.1941 c1cc(ccn1)c2cnc3ccsc3c2 6c71782add6eb5e1df1c850955f1e17f [0,0,0,1,0,0|2,1,0]=4 118 B17R3.1941 c1cc(ccn1)c2cnc3ncoc3c2 73fae8c797f3f8e9031d7074dd234956 [0,0,0,1,0,0|3,0,0]=4 119 B17R3.1941 c1cc(cnn1)c2ccc3ccoc3c2 12ecf23806604088fbaccf00a96347a8 [0,0,0,1,0,0|3,0,0]=4 120 B17R3.1941 c1cc(cnn1)c2cnc3ccoc3c2 d7d0aa8304172945a7b800ad8729030e [0,0,0,1,0,0|3,0,0]=4 121 B17R3.1941 c1cc(ncn1)c2ccc3ccoc3c2 8b80aacab3e7884ccf6c86070e182683 [0,0,0,1,0,0|3,0,0]=4 122 B17R3.1941 c1cc(ncn1)c2cnc3ccoc3c2 5e0ba8e7590f39d014f268b2256c8c76 [0,0,0,1,0,0|3,0,0]=4 123 B17R3.1941 c1ccc(cc1)c2c[nH]c-3cnnc3c2 d770ef9c73deb23914ec557f39799081 [0,0,0,1,0,0|3,0,0]=4 124 B17R3.1941 c1ccc(cc1)c2cc3[nH]ccc3cn2 5f5442d7430261d46f6f596e26709dae [0,0,0,1,0,0|3,0,0]=4 125 B17R3.1941 c1ccc(cc1)c2cc3sccc3cn2 e83fd341ee787c033ab5cf3938a8a50e [0,0,0,1,0,0|2,1,0]=4 126 B17R3.1941 c1ccc(cc1)c2ccc3[nH]ccc3c2 7a5a5fb0cd22a1d850ad2e1dc4b9b009 [0,0,0,1,0,0|3,0,0]=4 127 B17R3.1941 c1ccc(cc1)c2ccc3c(c2)OCC3 0b059c28edd31510ffd85e84560803c7 [0,0,0,1,0,0|1,0,2]=4 128 B17R3.1941 c1ccc(cc1)c2ccc3cc[nH]c3c2 afb0d415d3789073490f02874dc53123 [0,0,0,1,0,0|2,0,0]=3 129 B17R3.1941 c1ccc(cc1)c2ccc3cc[nH]c3n2 afd41f8ce48aa8fcb6e273bde96f295c [0,0,0,1,0,0|3,0,0]=4 130 B17R3.1941 c1ccc(cc1)c2ccc3cccn3c2 56994ab5fa23b4a3347dde4d70522e7d [0,0,0,1,0,0|3,0,0]=4 131 B17R3.1941 c1ccc(cc1)c2ccc3ccnn3c2 e7f4249073285f5ed1073986a947a683 [0,0,0,1,0,0|3,0,0]=4 132 B17R3.1941 c1ccc(cc1)c2ccc3ccoc3c2 f21edd901498862f00ee9723cc472664 [0,0,0,1,0,0|1,0,0]=2 133 B17R3.1941 c1ccc(cc1)c2ccc3ccoc3n2 853056ae21e8d2219cfbbb396fd7e219 [0,0,0,1,0,0|2,0,0]=3 134 B17R3.1941 c1ccc(cc1)c2ccc3ccsc3c2 c0f906e7e63ab4f57b6b6fe565aeb3be [0,0,0,1,0,0|1,1,0]=3 135 B17R3.1941 c1ccc(cc1)c2ccc3ccsc3n2 f4a0ebb7e43446ffaf31716d824c007f [0,0,0,1,0,0|2,1,0]=4 136 B17R3.1941 c1ccc(cc1)c2ccc3cn[nH]c3c2 364e57bc90b7dbcbe436f1dc0ebf9b6d [0,0,0,1,0,0|3,0,0]=4 137 B17R3.1941 c1ccc(cc1)c2ccc3cnoc3c2 fad3c47975299a942bee9f2bef3332b6 [0,0,0,1,0,0|2,0,0]=3 138 B17R3.1941 c1ccc(cc1)c2ccc3cnsc3c2 e62517ec1f7e61db9d64a43916892030 [0,0,0,1,0,0|2,1,0]=4 139 B17R3.1941 c1ccc(cc1)c2ccc3conc3c2 44f38f51e95063b3075325625701bef3 [0,0,0,1,0,0|3,0,0]=4 140 B17R3.1941 c1ccc(cc1)c2ccc3cscc3c2 80366dfe1f5e0046ded6cb968060dc6c [0,0,0,1,0,0|3,0,0]=4 141 B17R3.1941 c1ccc(cc1)c2ccc3csnc3c2 220ee785e56b5830473933b7787566cc [0,0,0,1,0,0|3,0,0]=4 142 B17R3.1941 c1ccc(cc1)c2ccc3nc[nH]c3c2 e3fcef990a1c03d5bb145350700cc177 [0,0,0,1,0,0|3,0,0]=4 143 B17R3.1941 c1ccc(cc1)c2ccc3ncoc3c2 8fbda2ac5d60191f2b1c021b7e13c8a3 [0,0,0,1,0,0|2,0,0]=3 144 B17R3.1941 c1ccc(cc1)c2ccc3ncoc3n2 e0f962ae4560fd2671316ef765bd8ef0 [0,0,0,1,0,0|3,0,0]=4 145 B17R3.1941 c1ccc(cc1)c2ccc3ncsc3c2 1d9cff9b65dfe698ab1e4a4d625cee26 [0,0,0,1,0,0|2,1,0]=4 146 B17R3.1941 c1ccc(cc1)c2ccc3occc3c2 f1a4e376b160075a1a2ef37e60547eda [0,0,0,1,0,0|3,0,0]=4 147 B17R3.1941 c1ccc(cc1)c2ccc3ocnc3c2 8b0260d59df7bb23fb4731f8585437c3 [0,0,0,1,0,0|3,0,0]=4 148 B17R3.1941 c1ccc(cc1)c2ccc3sccc3c2 75b83c6f13143f17157b6c5ef0dfec3f [0,0,0,1,0,0|3,0,0]=4 149 B17R3.1941 c1ccc(cc1)c2ccc3scnc3c2 c55cb98bc81cf3477b066213e5c33930 [0,0,0,1,0,0|3,0,0]=4 150 B17R3.1941 c1ccc(cc1)c2ccn3ccnc3c2 30ee5f07eb18a49b851b7c7b84aeaedc [0,0,0,1,0,0|3,0,0]=4 151 B17R3.1941 c1ccc(cc1)c2ccn3cncc3c2 eb8008755916fb650717a5adbbc767d2 [0,0,0,1,0,0|3,0,0]=4 152 B17R3.1941 c1ccc(cc1)c2ccn3nccc3c2 cb9abb6149827c8066cf0f5d43568352 [0,0,0,1,0,0|3,0,0]=4 153 B17R3.1941 c1ccc(cc1)c2cnc3[nH]ccc3c2 efbf0384693295cc2ba418ec3a48d22e [0,0,0,1,0,0|3,0,0]=4 154 B17R3.1941 c1ccc(cc1)c2cnc3cc[nH]c3c2 516c0fcae7849bef3e376634836841a7 [0,0,0,1,0,0|2,0,0]=3 155 B17R3.1941 c1ccc(cc1)c2cnc3cc[nH]c3n2 f003b3f540381e1e0670bf3f7d8ffc28 [0,0,0,1,0,0|3,0,0]=4 156 B17R3.1941 c1ccc(cc1)c2cnc3cccn3c2 a134b53c95eaf20af17e2bb2d2204b72 [0,0,0,1,0,0|3,0,0]=4 157 B17R3.1941 c1ccc(cc1)c2cnc3ccnn3c2 f49362f31779d072154734a5b2d64449 [0,0,0,1,0,0|3,0,0]=4 158 B17R3.1941 c1ccc(cc1)c2cnc3ccoc3c2 1636faded48611f75125c1e28132e43d [0,0,0,1,0,0|1,0,0]=2 159 B17R3.1941 c1ccc(cc1)c2cnc3ccsc3c2 340ac0f8415e880d0ff8729a5705c499 [0,0,0,1,0,0|1,1,0]=3 160 B17R3.1941 c1ccc(cc1)c2cnc3cn[nH]c3c2 af91abdbaea2b35e62580d1b3b0f4c3f [0,0,0,1,0,0|3,0,0]=4 161 B17R3.1941 c1ccc(cc1)c2cnc3csnc3c2 1ef0a04976465032a49d4f09229685ad [0,0,0,1,0,0|3,0,0]=4 162 B17R3.1941 c1ccc(cc1)c2cnc3nc[nH]c3c2 f08ebce901bb8640920a1b82e529014d [0,0,0,1,0,0|3,0,0]=4 163 B17R3.1941 c1ccc(cc1)c2cnc3ncoc3c2 260683837ae7dffd1741641a4bc90724 [0,0,0,1,0,0|2,0,0]=3 164 B17R3.1941 c1ccc(cc1)c2cnc3ncsc3c2 e739f22ba0e915cd69a3abb88ad83bdd [0,0,0,1,0,0|2,1,0]=4 165 B17R3.1941 c1ccc(cc1)c2cnc3occc3c2 f5fbf287e78f016a46cf740e5daae8c8 [0,0,0,1,0,0|3,0,0]=4 166 B17R3.1941 c1ccc(cc1)c2cnc3ocnc3c2 41dafbe2516a43ea86f0d79e78ca7af9 [0,0,0,1,0,0|3,0,0]=4 167 B17R3.1941 c1ccc(cc1)c2cnc3sccc3c2 189ab60fc74b45164fa0a340619281ca [0,0,0,1,0,0|3,0,0]=4 168 B17R3.1941 c1ccc(cc1)c2cnc3scnc3c2 5c58e3caf7475896d391556e368760d5 [0,0,0,1,0,0|3,0,0]=4 169 B17R3.1941 c1ccc(cc1)c2cnn3ccnc3c2 d27c6530e4090614c09ca8c86024e306 [0,0,0,1,0,0|3,0,0]=4 170 B17R3.1941 c1ccc(cc1)c2ncc3ccoc3n2 705bd03f8fe13fd198d5abcfcde1d223 [0,0,0,1,0,0|3,0,0]=4 171 B17R3.1941 c1ccc(nc1)c2ccc3cc[nH]c3c2 91a766e85a217183d6672521e1be07ad [0,0,0,1,0,0|3,0,0]=4 172 B17R3.1941 c1ccc(nc1)c2ccc3ccoc3c2 4230de7d8a0d7af168c804554539ae5e [0,0,0,1,0,0|2,0,0]=3 173 B17R3.1941 c1ccc(nc1)c2ccc3ccoc3n2 72b04d1dcc587f5cdf05337b9e2f023e [0,0,0,1,0,0|3,0,0]=4 174 B17R3.1941 c1ccc(nc1)c2ccc3ccsc3c2 9391920981ba269178e8624b9200c389 [0,0,0,1,0,0|2,1,0]=4 175 B17R3.1941 c1ccc(nc1)c2ccc3cnoc3c2 e5df18af7a763b177a297177bb0949cd [0,0,0,1,0,0|3,0,0]=4 176 B17R3.1941 c1ccc(nc1)c2ccc3ncoc3c2 2906109bd47d2db2570f2e69007beb3c [0,0,0,1,0,0|3,0,0]=4 177 B17R3.1941 c1ccc(nc1)c2cnc3cc[nH]c3c2 44239a00e260833dafadf46bb8097c47 [0,0,0,1,0,0|3,0,0]=4 178 B17R3.1941 c1ccc(nc1)c2cnc3ccoc3c2 8abd04cba1e7e4da79a09ee15267b508 [0,0,0,1,0,0|2,0,0]=3 179 B17R3.1941 c1ccc(nc1)c2cnc3ccsc3c2 0dfb61f240f5f8969fdf1a7f8cac47dd [0,0,0,1,0,0|2,1,0]=4 180 B17R3.1941 c1ccc(nc1)c2cnc3ncoc3c2 65f4c8593299288120127aae6819605d [0,0,0,1,0,0|3,0,0]=4 181 B17R3.1941 c1cnc(cn1)c2ccc3ccoc3c2 cebbb6e2f502ec958a2716b8d8b07732 [0,0,0,1,0,0|3,0,0]=4 182 B17R3.1941 c1cnc(cn1)c2cnc3ccoc3c2 77317cd8bd9063b6328a82456d6adf77 [0,0,0,1,0,0|3,0,0]=4 183 B17R3.1941 c1cnc(nc1)c2ccc3ccoc3c2 7c6c0da720acfc5916d41d95421ff318 [0,0,0,1,0,0|3,0,0]=4 184 B17R3.1941 c1cnc(nc1)c2cnc3ccoc3c2 0d05eb0763dc3698d8b65b5408ca6f5c [0,0,0,1,0,0|3,0,0]=4 185 B17R3.1941 c1cncc(c1)c2ccc3cc[nH]c3c2 7f3fc7d0061feae4523b8123e6d8a726 [0,0,0,1,0,0|3,0,0]=4 186 B17R3.1941 c1cncc(c1)c2ccc3ccoc3c2 b302f3ea4fec123bac616995d542a0d8 [0,0,0,1,0,0|2,0,0]=3 187 B17R3.1941 c1cncc(c1)c2ccc3ccoc3n2 8471f6af07653855288065f9e4dfd5cb [0,0,0,1,0,0|3,0,0]=4 188 B17R3.1941 c1cncc(c1)c2ccc3ccsc3c2 59f2c2a85257988b2ea522a063491609 [0,0,0,1,0,0|2,1,0]=4 189 B17R3.1941 c1cncc(c1)c2ccc3cnoc3c2 55703ed435d87d978b4629c46f474a24 [0,0,0,1,0,0|3,0,0]=4 190 B17R3.1941 c1cncc(c1)c2ccc3ncoc3c2 25768365a4383632f5fbea72c85d3db7 [0,0,0,1,0,0|3,0,0]=4 191 B17R3.1941 c1cncc(c1)c2cnc3cc[nH]c3c2 bebe3f01015c9c4e6e21b1aeda8e70c8 [0,0,0,1,0,0|3,0,0]=4 192 B17R3.1941 c1cncc(c1)c2cnc3ccoc3c2 22fe80049bb93aef1f889c21d5fe7e6d [0,0,0,1,0,0|2,0,0]=3 193 B17R3.1941 c1cncc(c1)c2cnc3ccsc3c2 79938d27ab376c29e97b551d600ad5f4 [0,0,0,1,0,0|2,1,0]=4 194 B17R3.1941 c1cncc(c1)c2cnc3ncoc3c2 63a0903c2c75d45f074ac3e5372c50b4 [0,0,0,1,0,0|3,0,0]=4 195 B17R3.1941 c1cnnc(c1)c2ccc3ccoc3c2 c5a8916105bf06e3af0551590a766b00 [0,0,0,1,0,0|3,0,0]=4 196 B17R3.1941 c1cnnc(c1)c2cnc3ccoc3c2 5f0588b453911b706fee2295a6227692 [0,0,0,1,0,0|3,0,0]=4 197 B17R3.1941 c1ncc(cn1)c2ccc3ccoc3c2 fcf094ba4ee9da8e613760917ee1d2a7 [0,0,0,1,0,0|3,0,0]=4 198 B17R3.1941 c1ncc(cn1)c2cnc3ccoc3c2 d069bf7a3205e1f8c617b14e54769ea1 [0,0,0,1,0,0|3,0,0]=4 199 B17R3.2681 c1ccc2c(c[nH]c2c1)Nc3ccno3 5663f6b8e7c5bc2ea22948ed7f7b1834 [0,0,0,1,0,0|3,0,0]=4 200 B17R3.2681 c1ccc2c(c[nH]c2c1)Nc3ncco3 a9d3279c7d6197dd13df345413de0c39 [0,0,0,1,0,0|3,0,0]=4 201 B17R3.2681 c1ccc2c(coc2c1)Nc3ccno3 24dd8aeb3da930da6bbd9a78e077005d [0,0,0,1,0,0|2,0,1]=4 202 B17R3.2681 c1ccc2c(csc2c1)Nc3ccno3 eb6a469a1e5e89e6300068bf6d4c5f58 [0,0,0,1,0,0|2,1,0]=4 203 B17R3.2681 c1coc(c1)Nc2c[nH]c3c2cccc3 b84fbf509b92490173272c96ba1a5c5f [0,0,0,1,0,0|2,0,0]=3 204 B17R3.2681 c1coc(c1)Nc2c[nH]c3c2nccc3 1eaa7f68acb71fd5ff143a6aba683e46 [0,0,0,1,0,0|3,0,0]=4 205 B17R3.2681 c1coc(c1)Nc2cnc3n2cccc3 517604cf9f6adb48584676a258cb9d36 [0,0,0,1,0,0|3,0,0]=4 206 B17R3.2681 c1coc(c1)Nc2n[nH]c3c2cccc3 0e6f05b96cd18d1a25bd927bfc4fa20f [0,0,0,1,0,0|3,0,0]=4 207 B17R3.2681 c1coc(c1)Nc2snc3c2cccc3 2ec9f279ac2a76b4bafba7abcce67bf6 [0,0,0,1,0,0|3,0,0]=4 208 B15R2.131 O=CN(c1ccccc1)c2nccs2 f5c370702c54fa44b46805b2c7e4c38a [0,0,0,0,1,0|2,1,0]=4 209 B17R2.162 O=CC(Nc1ccccc1)c2ccccc2 5bfb5165762045205d68ca8a2de6494c [0,0,0,0,0,1|2,0,1]=4 210 B17R2.162 O=CC(Nc1ccccn1)c2ccccc2 c4871645c7b0fde03c335c81bbbb9fa9 [0,0,0,0,0,1|2,0,1]=4 211 B17R2.162 O=CC(Nc1cccnc1)c2ccccc2 578931f99c76659b1b11e833a461016f [0,0,0,0,0,1|2,0,1]=4 212 B17R2.162 O=CC(Nc1cccnn1)c2ccccc2 771dd9ee15e72733b1dd2a6fbee315a4 [0,0,0,0,0,1|2,0,1]=4 213 B17R2.162 O=CC(Nc1ccncc1)c2ccccc2 9b17e78bad311d53086f1963e2f17ee7 [0,0,0,0,0,1|2,0,1]=4 214 B17R2.162 O=CC(Nc1ccncn1)c2ccccc2 508e2ee45e84dff0400619f1dd640d0b [0,0,0,0,0,1|2,0,1]=4 215 B17R2.162 O=CC(Nc1cnccn1)c2ccccc2 ddbf67998922d3169d3546f93f3116de [0,0,0,0,0,1|2,0,1]=4 216 B17R2.162 O=CC(Nc1ncccn1)c2ccccc2 f8335e21192123711e97a1bc74bbb913 [0,0,0,0,0,1|2,0,1]=4 217 B17R2.162 O=CC(Oc1ccccn1)c2ccccc2 4c41be5ba0355c92707187ac98dfd252 [0,0,0,0,0,1|2,0,1]=4 218 B17R2.162 O=CC(Oc1cccnc1)c2ccccc2 bdbb449579ca695dcb886ec86a293561 [0,0,0,0,0,1|2,0,1]=4 219 B17R2.162 O=CC(Oc1ccncc1)c2ccccc2 ec00069ea197c66d49612e1dcb24ea42 [0,0,0,0,0,1|2,0,1]=4 220 B17R2.162 O=CC(Oc1cnccn1)c2ccccc2 c41ce425292d1b14e8c8ae590471f3e8 [0,0,0,0,0,1|2,0,1]=4 221 B17R2.162 O=CC(Oc1ncccn1)c2ccccc2 5aa33ff858e1002df5e329074cf03473 [0,0,0,0,0,1|2,0,1]=4 222 B17R2.162 O=CN(Cc1ccccc1)c2ccccc2 59373796f09ab4f7f618bee231df1c95 [0,0,0,0,0,1|2,0,1]=4 223 B17R2.162 O=CN(Cc1cccnc1)c2ccccc2 49379e0e261916775fe2789d3691968a [0,0,0,0,0,1|2,0,1]=4 224 B17R2.162 O=CN(Cc1ccncc1)c2ccccc2 74e4439416afbe2efb4b2c364826e554 [0,0,0,0,0,1|2,0,1]=4 225 B17R2.6053 O=CC(Cc1ccccc1)Nc2cccs2 662eeda2de4217b86f86599c4ee1b2ab [0,0,0,0,0,1|1,1,1]=4 226 B17R2.6053 O=CC(Cc1ccccc1)Nc2ccno2 ce039cd6fc3a716ddc0aeed851016e5f [0,0,0,0,0,1|2,0,1]=4 227 B17R2.6053 O=CC(Cc1ccccc1)Nc2ncco2 0ef92a6d07f4d5b6adc1b961eec53175 [0,0,0,0,0,1|2,0,1]=4 228 B17R2.6053 O=CC(Cc1ccccc1)Oc2ccco2 e7308510dd3ec2f8bb599ed23a600717 [0,0,0,0,0,1|1,0,1]=3 229 B17R2.6053 O=CC(Cc1ccccc1)Oc2cccs2 bdce34fe1423af43440d35eac6e544f6 [0,0,0,0,0,1|1,1,1]=4 230 B17R2.6053 O=CN(Cc1ccccc1)Cc2ccco2 77be31a54a7e7d7a4784f28f8a13311a [0,0,0,0,0,1|1,0,1]=3 231 B17R2.6053 O=CN(Cc1ccccc1)Cc2cccs2 b8b7ee58a1458480eb55860b236caeab [0,0,0,0,0,1|1,1,1]=4 232 B17R2.6053 O=CN(Cc1cccnc1)Cc2ccco2 9e0964024d3324876efae6c88f544896 [0,0,0,0,0,1|2,0,1]=4 233 B17R2.6053 O=CN(Cc1ccncc1)Cc2ccco2 b30c8429e62051e3248e9f8b8e2c9c34 [0,0,0,0,0,1|2,0,1]=4 234 B17R2.17880 C=CC(NCc1ccco1)c2ccccc2 0864b40b07b4bd0fac3562b2006e475c [0,0,0,0,0,1|1,0,2]=4 235 B17R2.17880 C=CC(OCc1ccco1)c2ccccc2 8e8c49dda34d47038e117df049f81b93 [0,0,0,0,0,1|1,0,2]=4 236 B17R2.17880 C=C[C@@H](NCc1ccco1)c2ccccc2 2c98ed689f8d4250b9885855e4ba9094 [0,0,0,0,0,1|1,0,2]=4 237 B17R2.17880 C=C[C@H](NCc1ccco1)c2ccccc2 53bfe3a6fe8ac36354850d6146556263 [0,0,0,0,0,1|1,0,2]=4 238 B17R2.17880 O=CC(NCc1ccc[nH]1)c2ccccc2 0aec63373f70e0b9cd431198afd7844a [0,0,0,0,0,1|1,0,2]=4 239 B17R2.17880 O=CC(NCc1ccco1)c2ccccc2 9e304a910f9121f408ca0523a8fe3127 [0,0,0,0,0,1|0,0,2]=3 240 B17R2.17880 O=CC(NCc1cccs1)c2ccccc2 c69d07485d125d3602fb281871d2bc18 [0,0,0,0,0,1|0,1,2]=4 241 B17R2.17880 O=CC(NCc1ccno1)c2ccccc2 2a5976cd15c0495fed41bd8ccbd2f866 [0,0,0,0,0,1|1,0,2]=4 242 B17R2.17880 O=CC(NCc1cnco1)c2ccccc2 6905fce422345184b01efc92e01d022c [0,0,0,0,0,1|1,0,2]=4 243 B17R2.17880 O=CC(OCc1ccc[nH]1)c2ccccc2 4728d00fc71a8d9a6ac102b49a129d16 [0,0,0,0,0,1|1,0,2]=4 244 B17R2.17880 O=CC(OCc1ccno1)c2ccccc2 b4ed75b08451661a0aa1b48de97abd6c [0,0,0,0,0,1|1,0,2]=4 245 B17R2.17880 O=CC(OCc1cnco1)c2ccccc2 697dd000c38298ae6cd37cd1c6e9ebd6 [0,0,0,0,0,1|1,0,2]=4 246 B14R1.121 C=CCO/C=C(\C=O)/c1ccccc1 9915ad0bf33770a6c3d99baa8f6b5a26 [1,0,1,0,0,0|0,0,1]=3 247 B14R1.121 C=CCO/C=C(\C=O)/c1ccccn1 53bf8ecc0b53d98b1b656c650c110485 [1,0,1,0,0,0|1,0,1]=4 248 B14R1.121 C=CCO/C=C(\C=O)/c1ccncc1 76141c2da5525af0e9cf09fc63fc3dc5 [1,0,1,0,0,0|1,0,1]=4 249 B14R1.121 O=CCO/C=C(\C=O)/c1ccccc1 9072b6ca606dea50ffe40f553cbff18c [1,0,1,0,0,0|1,0,1]=4 250 B14R2.101 c1ccc(cc1)COc2ccco2 a7325d36519b0e095010d207cd265305 [2,0,0,0,0,0|1,0,1]=4 251 B14R2.101 c1ccc(cc1)NCc2ccco2 2bb95fc9ffe7aabe9bffafcf34550ade [2,0,0,0,0,0|1,0,1]=4 252 B16R2.125 Cc1ccc(cc1)C(=O)Nc2cccs2 a5b87a346e7beceed04c426eff7f40fc [1,1,0,0,0,0|1,1,0]=4 253 B16R2.125 Cc1ccc(cc1)C(=O)Nc2ccno2 3a132be74f128a8549f45ef5498c96c7 [1,1,0,0,0,0|2,0,0]=4 254 B16R2.125 Cc1ccc(cc1)C(=O)Nc2ncco2 052ad4f093ece22ff11c0c666686d476 [1,1,0,0,0,0|2,0,0]=4 255 B16R2.125 O=C(Nc1cccs1)c2ccc(cc2)Br d1de9d721554fcf511012eeb9b96ef28 [1,1,0,0,0,0|1,1,0]=4 256 B16R2.125 O=C(Nc1cccs1)c2ccc(cc2)Cl d03239c529ecc2a6cc22ff21cba21f6b [1,1,0,0,0,0|1,1,0]=4 257 B16R2.125 O=C(Nc1cccs1)c2ccc(cc2)F fe059bd89224add386d8814814d261d7 [1,1,0,0,0,0|1,1,0]=4 258 B16R2.125 O=C(Nc1cccs1)c2ccc(cc2)I fcc17c63b6ffac8a38d27f8bac14941d [1,1,0,0,0,0|1,1,0]=4 259 B16R2.125 O=C(Nc1cccs1)c2ccc(cc2)O 3a83408194812ab6835ea8f0374bbaeb [1,1,0,0,0,0|1,1,0]=4 260 B16R2.125 O=C(Nc1cccs1)c2ccc(cc2)S bdd0b739398346dbb91a92690caead09 [1,1,0,0,0,0|1,1,0]=4 261 B16R2.125 O=C(Nc1ccno1)c2ccc(cc2)Br a74e11b1ddb9634ff1ad529f0589d1f4 [1,1,0,0,0,0|2,0,0]=4 262 B16R2.125 O=C(Nc1ccno1)c2ccc(cc2)Cl d5866c074a19a96dc84e98ef9035de34 [1,1,0,0,0,0|2,0,0]=4 263 B16R2.125 O=C(Nc1ccno1)c2ccc(cc2)F 5ef3b4366f31ea357273122a6136f92d [1,1,0,0,0,0|2,0,0]=4 264 B16R2.125 O=C(Nc1ccno1)c2ccc(cc2)I 73f651bc63cc769f206259d87c0980b0 [1,1,0,0,0,0|2,0,0]=4 265 B16R2.125 O=C(Nc1ccno1)c2ccc(cc2)O 0c81626159eefb4c1edd87a959ccfe8d [1,1,0,0,0,0|2,0,0]=4 266 B16R2.125 O=C(Nc1ccno1)c2ccc(cc2)S 0de87c23b40dba81ac6a419f453f1118 [1,1,0,0,0,0|2,0,0]=4 267 B16R2.125 O=C(Nc1ncco1)c2ccc(cc2)Br 97a74d778402f3cfa6b076e8d61c58d6 [1,1,0,0,0,0|2,0,0]=4 268 B16R2.125 O=C(Nc1ncco1)c2ccc(cc2)F b3fa0190fb5f8cca4c0fd3a66ab24579 [1,1,0,0,0,0|2,0,0]=4 269 B16R2.125 O=C(Nc1ncco1)c2ccc(cc2)I 3065164acf40dfc3bd81645da6c2fdbe [1,1,0,0,0,0|2,0,0]=4 270 B16R2.125 O=C(Nc1ncco1)c2ccc(cc2)O 79aa98df09d81c734fa75a53728dffe0 [1,1,0,0,0,0|2,0,0]=4 271 B16R2.125 O=C(Nc1ncco1)c2ccc(cc2)S e8b50e9a3fb08883a8a0a27c13a38256 [1,1,0,0,0,0|2,0,0]=4 272 B16R2.243 Cc1cccc(c1)C(=O)Nc2cccs2 4b2aa4f3374a20e1d55bf6267b022b7b [1,1,0,0,0,0|1,1,0]=4 273 B16R2.243 Cc1cccc(c1)C(=O)Nc2ccno2 94e1829ceb0191d2fe8d405b2c28b8d8 [1,1,0,0,0,0|2,0,0]=4 274 B16R2.243 Cc1cccc(c1)C(=O)Nc2ncco2 ae33cc7915da1e928d6a5862dd40ae87 [1,1,0,0,0,0|2,0,0]=4 275 B16R2.243 O=C(Nc1cccs1)c2cccc(c2)Br 4b8dda9f08e009929bb6fef467e064f8 [1,1,0,0,0,0|1,1,0]=4 276 B16R2.243 O=C(Nc1cccs1)c2cccc(c2)Cl 8fb0ee2204e3b3591d028fdd635d0cb5 [1,1,0,0,0,0|1,1,0]=4 277 B16R2.243 O=C(Nc1cccs1)c2cccc(c2)F 1ede4c10095aa2c1f4053333aaf97159 [1,1,0,0,0,0|1,1,0]=4 278 B16R2.243 O=C(Nc1cccs1)c2cccc(c2)I b82a9a7c7ddbcada40e3cfaa977516a6 [1,1,0,0,0,0|1,1,0]=4 279 B16R2.243 O=C(Nc1cccs1)c2cccc(c2)O 6d9ff898de17d4996858a8279a0cb228 [1,1,0,0,0,0|1,1,0]=4 280 B16R2.243 O=C(Nc1cccs1)c2cccc(c2)S 1352b1beca0994006a1833de627cfade [1,1,0,0,0,0|1,1,0]=4 281 B16R2.243 O=C(Nc1ccno1)c2cccc(c2)Br 9426af1026e34983ef15455aa6eef71f [1,1,0,0,0,0|2,0,0]=4 282 B16R2.243 O=C(Nc1ccno1)c2cccc(c2)Cl 4dffec1f538627adc7f76940a8c1bc5a [1,1,0,0,0,0|2,0,0]=4 283 B16R2.243 O=C(Nc1ccno1)c2cccc(c2)F fea020e9fa8a9a914bd827fd95439f2c [1,1,0,0,0,0|2,0,0]=4 284 B16R2.243 O=C(Nc1ccno1)c2cccc(c2)I 646a8d351215deae6212f2ba71197312 [1,1,0,0,0,0|2,0,0]=4 285 B16R2.243 O=C(Nc1ccno1)c2cccc(c2)O cc1dfac319e743e99e48faa79bab0e56 [1,1,0,0,0,0|2,0,0]=4 286 B16R2.243 O=C(Nc1ccno1)c2cccc(c2)S c1ed4bb8901389a74c7ef00b20945b82 [1,1,0,0,0,0|2,0,0]=4 287 B16R2.243 O=C(Nc1ncco1)c2cccc(c2)Br 2cb4d096512f02089177564de5a4bf30 [1,1,0,0,0,0|2,0,0]=4 288 B16R2.243 O=C(Nc1ncco1)c2cccc(c2)Cl ccc1c9cac4f781731d5170d1a19a1e07 [1,1,0,0,0,0|2,0,0]=4 289 B16R2.243 O=C(Nc1ncco1)c2cccc(c2)F 2a2265d1f6b44042647724447045c3c8 [1,1,0,0,0,0|2,0,0]=4 290 B16R2.243 O=C(Nc1ncco1)c2cccc(c2)I 0cc21f472b229e5f32e3c7f9db33b3f9 [1,1,0,0,0,0|2,0,0]=4 291 B16R2.243 O=C(Nc1ncco1)c2cccc(c2)O f896aef3dd47e9225a09081c021387db [1,1,0,0,0,0|2,0,0]=4 292 B16R2.243 O=C(Nc1ncco1)c2cccc(c2)S ce8fc0f66a4b21f33e21f5d17f542ad2 [1,1,0,0,0,0|2,0,0]=4 293 B16R2.2829 Cc1cc(on1)NC(=O)c2ccccc2 f118be9df0b79a19ac82f2253c69d3ec [1,1,0,0,0,0|2,0,0]=4 294 B16R2.2829 Cc1ccc(s1)NC(=O)c2ccccc2 3917c648b48d99d9ee35ebff64f3879c [1,1,0,0,0,0|1,1,0]=4 295 B16R2.2829 Cc1cnc(o1)NC(=O)c2ccccc2 9baca506f89937229ecf314b166c8e07 [1,1,0,0,0,0|2,0,0]=4 296 B16R2.2829 Cc1coc(n1)NC(=O)c2ccccc2 4ed0811b119eed65130903103275137b [1,1,0,0,0,0|2,0,0]=4 297 B16R2.2829 Cc1ncc(o1)NC(=O)c2ccccc2 0fbbf90e361d75283d4d97ab6c6f4cd6 [1,1,0,0,0,0|2,0,0]=4 298 B16R2.2829 O=C(Nc1ccc(s1)Br)c2ccccc2 1ef073be7ec1ef9c12338e8e96a86ddb [1,1,0,0,0,0|1,1,0]=4 299 B16R2.2829 O=C(Nc1nc(co1)Br)c2ccccc2 2669fe707c1372fe936a3ad7cb09511a [1,1,0,0,0,0|2,0,0]=4 300 B16R2.2965 Cc1ccccc1C(=O)Nc2cccs2 e1094f2ce65bb3dec1f10cebda015b00 [1,1,0,0,0,0|1,1,0]=4 301 B16R2.2965 Cc1ccccc1C(=O)Nc2ccno2 bf713c1e9c1644597551cdc2c447aeeb [1,1,0,0,0,0|2,0,0]=4 302 B16R2.2965 O=C(Nc1cccs1)c2ccccc2Br 9c04e51c2ba9928e17990f80d2beda90 [1,1,0,0,0,0|1,1,0]=4 303 B16R2.2965 O=C(Nc1cccs1)c2ccccc2Cl 3cc76122a012059b94a76b10c4c19fd0 [1,1,0,0,0,0|1,1,0]=4 304 B16R2.2965 O=C(Nc1cccs1)c2ccccc2F 1125c4dc2a8b9b35f738f99137594f7c [1,1,0,0,0,0|1,1,0]=4 305 B16R2.2965 O=C(Nc1cccs1)c2ccccc2I ed2c768e753509184f25a79193654974 [1,1,0,0,0,0|1,1,0]=4 306 B16R2.2965 O=C(Nc1cccs1)c2ccccc2O 637c2518cc9d15bac5ac6ad04bca4070 [1,1,0,0,0,0|1,1,0]=4 307 B16R2.2965 O=C(Nc1cccs1)c2ccccc2S 362b20ddec4cb4a8ef9017c6e08ceb40 [1,1,0,0,0,0|1,1,0]=4 308 B16R2.2965 O=C(Nc1ccno1)c2ccccc2Br 2067884c05da94dea9047f230c1a83fc [1,1,0,0,0,0|2,0,0]=4 309 B16R2.2965 O=C(Nc1ccno1)c2ccccc2Cl e8df279c0a41c9ce33ced96eb1f2d88a [1,1,0,0,0,0|2,0,0]=4 310 B16R2.2965 O=C(Nc1ccno1)c2ccccc2F 3e74221cce0be3788d923715c16e6e72 [1,1,0,0,0,0|2,0,0]=4 311 B16R2.2965 O=C(Nc1ccno1)c2ccccc2I 557d3b10874fc76d24c2d2d31890e0b9 [1,1,0,0,0,0|2,0,0]=4 312 B16R2.2965 O=C(Nc1ccno1)c2ccccc2S 879bb1685065d4c1cc00abd0c5bf525b [1,1,0,0,0,0|2,0,0]=4 313 B16R2.2965 O=C(Nc1ncco1)c2ccccc2Br 60b53b951cd9db1045260e7bacde76a0 [1,1,0,0,0,0|2,0,0]=4 314 B16R2.2965 O=C(Nc1ncco1)c2ccccc2F 12b06b11afa852b9adfa9b0789016313 [1,1,0,0,0,0|2,0,0]=4 315 B16R2.2965 O=C(Nc1ncco1)c2ccccc2I 56e3374ea81d810851a93873420b9eb9 [1,1,0,0,0,0|2,0,0]=4 316 B16R2.2965 O=C(Nc1ncco1)c2ccccc2S 63d1d7a82d85f37c7bb3f0e6dd2bdf50 [1,1,0,0,0,0|2,0,0]=4 317 B16R2.6780 CN(C(=O)c1ccccc1)c2ncco2 0f3ed88c51a53565af2f7f6f8f02d158 [1,1,0,0,0,0|2,0,0]=4 318 B16R2.6780 CN(C(=O)c1ccco1)c2ccccc2 79980b4e4de477020c5c8dc755d93a96 [1,1,0,0,0,0|1,0,1]=4 319 B16R2.100 O=CNC(c1ccccc1)c2cccs2 99e4eb285dd5c8128e145ace79213fe5 [0,1,0,0,1,0|0,1,1]=4 320 B18R2.7830 O=CC(Oc1coccc1=O)c2ccccc2 6327bbd5ad05f8083dff9a53c23b2340 [0,1,0,0,0,1|1,0,1]=4 321 B18R2.2114 O=CCN(Cc1ccccc1)Cc2ccco2 2a6d3ddb6f747a40de1f3b61e8defa1b [0,1,0,0,0,1|1,0,1]=4 322 B18R2.7819 O=CN(Cc1ccc(cc1)O)Cc2ccco2 b45a1429d19bc31300a17595d7f2de97 [0,1,0,0,0,1|1,0,1]=4 323 B18R2.7838 CC(c1ccccc1)N(C=O)Cc2ccco2 472a2d5b49e4372b51b17aaeebfbdaf6 [0,1,0,0,0,1|1,0,1]=4 324 B18R2.33880 CC(=O)N(Cc1ccccc1)Cc2ccco2 7e0443bb4002dfc6ef3c471d292d7e78 [0,1,0,0,0,1|1,0,1]=4 325 B18R2.2319 CN(Cc1ccco1)C(C=O)c2ccccc2 ae7e7db6bd4064f2af77dff51da3990f [0,1,0,0,0,1|0,0,2]=4 326 B18R2.7228 C=CC(NC(=O)c1ccco1)c2ccccc2 b2f055fb9642c06cb19dc166a187164c [0,1,0,0,0,1|1,0,1]=4 327 B18R2.7228 C=C[C@@H](NC(=O)c1ccco1)c2ccccc2 731146e89c7f135ef840f447379de306 [0,1,0,0,0,1|1,0,1]=4 328 B18R2.7228 C=C[C@H](NC(=O)c1ccco1)c2ccccc2 1242ed7aeee8837e0b469e15ac7dec94 [0,1,0,0,0,1|1,0,1]=4 329 B18R2.7228 CC(NC(C=O)c1ccccc1)c2ccco2 946f6eec6d1a2eaf46bebf4c8488f581 [0,1,0,0,0,1|0,0,2]=4 330 B18R2.7228 CC(OC(C=O)c1ccccc1)c2ccco2 b1c9bb6256116c7837e98bf70284b7e7 [0,1,0,0,0,1|0,0,2]=4 331 B18R2.7228 C[C@@H](NC(C=O)c1ccccc1)c2ccco2 461d6a5c8ca238dc7a0861b2b3e10763 [0,1,0,0,0,1|0,0,2]=4 332 B18R2.7228 C[C@@H](OC(C=O)c1ccccc1)c2ccco2 f7907c3a4072195c643f0c854a37dbbd [0,1,0,0,0,1|0,0,2]=4 333 B18R2.12689 CC(=O)C(NCc1ccco1)c2ccccc2 265e713e7a80bc70d5e89ac95e954c7c [0,1,0,0,0,1|0,0,2]=4 334 B18R2.12689 CC(=O)C(OCc1ccco1)c2ccccc2 23e46b1147ec8661c7af4e6d019f5e81 [0,1,0,0,0,1|0,0,2]=4 335 B18R2.12689 NC(=O)C(NCc1ccco1)c2ccccc2 b8f96f76261fbf6decd4549a57f10277 [0,1,0,0,0,1|0,0,2]=4 336 B18R2.12689 NC(=O)C(OCc1ccco1)c2ccccc2 47c47beb6756f86d1d8542a180e30680 [0,1,0,0,0,1|0,0,2]=4 337 B18R2.12689 NC(=O)[C@@H](NCc1ccco1)c2ccccc2 6fb66cf8a129da1efad0afc08587e620 [0,1,0,0,0,1|0,0,2]=4 338 B18R2.12689 NC(=O)[C@@H](OCc1ccco1)c2ccccc2 b4790c0828b326b60a1a690a5227414b [0,1,0,0,0,1|0,0,2]=4 339 B18R2.12689 NC(=O)[C@H](NCc1ccco1)c2ccccc2 a729a2c22439e4d1f54aeec56a07a196 [0,1,0,0,0,1|0,0,2]=4 340 B18R2.12689 NC(=O)[C@H](OCc1ccco1)c2ccccc2 40783017c41bfa9144fde453ceed1125 [0,1,0,0,0,1|0,0,2]=4 341 B18R2.12689 O=C(O)C(CNc1ccco1)c2ccccc2 f8734f3ece7dcba78ebf9d8a05be5d14 [0,1,0,0,0,1|0,0,2]=4 342 B18R2.12689 O=C(O)C(NCc1ccco1)c2ccccc2 062e508a5e43b5ab10fbe16bf6228057 [0,1,0,0,0,1|0,0,2]=4 343 B18R2.12689 O=C(O)C(OCc1ccco1)c2ccccc2 c31581771d7d1aa7d1aff7e4c308a3a0 [0,1,0,0,0,1|0,0,2]=4 344 B18R2.12689 O=C(O)[C@@H](CNc1ccco1)c2ccccc2 5590459ed62a57378b37477fac78453a [0,1,0,0,0,1|0,0,2]=4 345 B18R2.12689 O=C(O)[C@@H](NCc1ccco1)c2ccccc2 70da2db7d298ecde290fed5483b2adf1 [0,1,0,0,0,1|0,0,2]=4 346 B18R2.12689 O=C(O)[C@@H](OCc1ccco1)c2ccccc2 d42492529b3a89f829c5e1dd3b794b34 [0,1,0,0,0,1|0,0,2]=4 347 B18R2.12689 O=C(O)[C@H](CNc1ccco1)c2ccccc2 49cb847bd5a09d0a166727593e7a3a85 [0,1,0,0,0,1|0,0,2]=4 348 B18R2.12689 O=C(O)[C@H](NCc1ccco1)c2ccccc2 87b04611910e713d4c58d053ad8d8660 [0,1,0,0,0,1|0,0,2]=4 349 B18R2.12689 O=C(O)[C@H](OCc1ccco1)c2ccccc2 e355b63509f290292935f9a4fa4dad26 [0,1,0,0,0,1|0,0,2]=4 350 B18R2.28251 Cc1ccc(o1)CNC(C=O)c2ccccc2 a181d8ae8b57931cacc100c4ca93d7c0 [0,1,0,0,0,1|0,0,2]=4 351 B18R2.28251 Cc1coc(c1)CNC(C=O)c2ccccc2 eff7779a207b7724e147cd8b30e8707a [0,1,0,0,0,1|0,0,2]=4 352 B18R2.28251 O=CC(NCc1ccc(o1)Br)c2ccccc2 4e884007cd2428e566f8cabe4c02b435 [0,1,0,0,0,1|0,0,2]=4 353 B18R2.127036 Cc1ccoc1CNC(C=O)c2ccccc2 ae880a85fe77702bec49548fbe2c527d [0,1,0,0,0,1|0,0,2]=4 354 B18R2.127036 Cc1ccoc1COC(C=O)c2ccccc2 cfaf5e846f225416328475f82f4a1e0a [0,1,0,0,0,1|0,0,2]=4 355 B18R2.912411 CC(C=O)(OCc1ccco1)c2ccccc2 7e433b31d9146ccaeaf64cd6450fd2c0 [0,1,0,0,0,1|0,0,2]=4 356 B18R2.201 Cc1ccc(o1)CN(C=O)c2ccc(cc2)F 7075375bf2fb23d5902ea95d4aad0b37 [0,2,0,0,0,0|1,0,1]=4 357 B18R2.360 Cc1ccc(cc1)N(CC=O)Cc2ccco2 8900465d2c5d6d06373e4fb9ca9e72c6 [0,2,0,0,0,0|1,0,1]=4 358 B18R2.360 O=CCN(Cc1ccco1)c2ccc(cc2)Cl 4bb732363607a9d6f9106f42db405384 [0,2,0,0,0,0|1,0,1]=4 359 B18R2.2597 COc1ccc(cc1)N(C=O)Cc2ccco2 8d0cbeb7f22968d90d91736545d766a6 [0,2,0,0,0,0|1,0,1]=4 360 B18R2.78644 Cc1cc(ccc1N(C=O)Cc2ccco2)F d118cec1d78e6215fd043cb45d0782e7 [0,2,0,0,0,0|1,0,1]=4 361 B18R2.78644 O=CN(Cc1ccco1)c2ccc(cc2F)F 439a0dd31468cba1a654486af05d6973 [0,2,0,0,0,0|1,0,1]=4 362 B18R2.78653 Cc1ccc(cc1C)N(C=O)Cc2ccco2 2c36e0a1a736f26e5bd71e5439cdf3aa [0,2,0,0,0,0|1,0,1]=4 363 B18R2.92911 CC(=O)N(Cc1ccco1)c2ccc(cc2)C 96cd80a8f2b0f3efcf1602b50f953eae [0,2,0,0,0,0|1,0,1]=4 364 B18R2.92911 CC(=O)N(Cc1ccco1)c2ccc(cc2)Cl 086122f25b648b056808dd63f160b306 [0,2,0,0,0,0|1,0,1]=4 365 B18R2.92911 CC(=O)N(Cc1ccco1)c2ccc(cc2)O e00417b4c265f7c2ac66a38c4006c2f9 [0,2,0,0,0,0|1,0,1]=4 366 B18R2.2106 O=CCN(Cc1ccco1)c2cccc(c2)Cl fc60c5e1b61914e825ccb630b8a38233 [0,2,0,0,0,0|1,0,1]=4 367 B18R2.2106 O=CCN(Cc1ccco1)c2cccc(c2)F d6fc6fb5ce9a2d3f377c46c73087b7e7 [0,2,0,0,0,0|1,0,1]=4 368 B18R2.7761 C=CCN(C(=O)c1ccco1)c2ccccc2 fd01154e03be63d0144472a1facf9fa2 [0,2,0,0,0,0|2,0,0]=4 369 B18R2.12686 NC(=O)CN(Cc1ccco1)c2ccccc2 7672c748168550c6eb64c5c5efb43160 [0,2,0,0,0,0|1,0,1]=4 370 B18R2.12686 O=C(O)CN(Cc1ccco1)c2ccccc2 0e036f0eae821e06bca7d0ed17b764be [0,2,0,0,0,0|1,0,1]=4 371 B18R2.14623 O=CCCN(Cc1ccco1)c2ccccc2 efc6bcdcb0b4f224cbb7da956fbde34c [0,2,0,0,0,0|1,0,1]=4 372 B18R2.21284 C#CC(=O)N(Cc1ccco1)c2ccccc2 915abd4f23ee46e242b4f6cad5568cfd [0,2,0,0,0,0|1,0,1]=4 373 B18R2.21284 C=CC(=O)N(Cc1ccco1)c2ccccc2 8194777266547cf263f306893da4506f [0,2,0,0,0,0|1,0,1]=4 374 B18R2.21284 CC(C=O)N(Cc1ccco1)c2ccccc2 ab75218a598c8119918afcb3fdd84a7b [0,2,0,0,0,0|1,0,1]=4 375 B18R2.21284 CCC(=O)N(Cc1ccco1)c2ccccc2 66734c0efbc76f04cdb217c439807b1e [0,2,0,0,0,0|1,0,1]=4 376 B18R2.21284 CNC(=O)C(Nc1ccco1)c2ccccc2 713a18a8b5c2196e4685a0e10959de20 [0,2,0,0,0,0|1,0,1]=4 377 B18R2.21284 CNC(=O)[C@@H](Nc1ccco1)c2ccccc2 d194a0bdfcca1d8dd5c100d447dd6087 [0,2,0,0,0,0|1,0,1]=4 378 B18R2.21284 CNC(=O)[C@H](Nc1ccco1)c2ccccc2 81aa1087dbc25472340b196dd27cd1ac [0,2,0,0,0,0|1,0,1]=4 379 B18R2.21284 C[C@H](C=O)N(Cc1ccco1)c2ccccc2 32bed61594b79d9c56bc079e62023fc6 [0,2,0,0,0,0|1,0,1]=4 380 B18R2.21284 O=C(CF)N(Cc1ccco1)c2ccccc2 d401ef6151a1f9ba299d1da7be5f2bed [0,2,0,0,0,0|1,0,1]=4 381 B18R2.21284 O=C(CO)N(Cc1ccco1)c2ccccc2 e9514bc1f9ad8f676ffd65e86cb3d97f [0,2,0,0,0,0|1,0,1]=4 382 B18R2.21284 O=C(NO)C(Nc1ccco1)c2ccccc2 cea96347aeb76158bc3d9d4c9a9bc285 [0,2,0,0,0,0|1,0,1]=4 383 B18R2.21284 O=CC(=O)N(Cc1ccco1)c2ccccc2 37cb49b12cfe98d73dc031f2d418570f [0,2,0,0,0,0|1,0,1]=4 384 B18R2.29833 Cc1ccc(o1)NC(C(=O)N)c2ccccc2 fe866536227b6383bb8a900f994a2b6d [0,2,0,0,0,0|1,0,1]=4 385 B18R2.29833 Cc1ccc(o1)N[C@@H](C(=O)N)c2ccccc2 ac41738106f8744ec48fe51aca902c53 [0,2,0,0,0,0|1,0,1]=4 386 B18R2.29833 Cc1ccc(o1)N[C@H](C(=O)N)c2ccccc2 00ab31fb53db921d6f45131a442c3c2e [0,2,0,0,0,0|1,0,1]=4 387 B18R2.31166 CC(=O)N(Cc1ccco1)c2cccc(c2)Cl f63678f2b0334779273307d9b5421fe9 [0,2,0,0,0,0|1,0,1]=4 388 B18R2.31166 CC(=O)N(Cc1ccco1)c2cccc(c2)F e926cfa27ceab7f4cb77ccbcf4d81e35 [0,2,0,0,0,0|1,0,1]=4 389 B18R2.782 N#Cc1ccoc1NC(C=O)c2ccccc2 b8332e366754fc7f306fec5a5a7e83ff [0,2,0,0,0,0|1,0,1]=4 390 B16R2.7 Br/C=C/c1ccc(cc1)c2ccccc2 bd78847c76bca1f509fac79f3cb890f9 [0,0,1,1,0,0|2,0,0]=4 391 B16R2.7 Br/C=C\c1ccc(cc1)c2ccccc2 6cdc5d818fd76e9abe62308d767ccaa8 [0,0,1,1,0,0|2,0,0]=4 392 B16R2.7 C/C=C/c1ccc(cc1)c2ccccc2 f96dbba94827c3b2e1479e7038c1f782 [0,0,1,1,0,0|2,0,0]=4 393 B16R2.24 C=Cc1cccc(c1F)c2ccccc2 91a0bc2311607bb4e46ef322177c2dc4 [0,0,1,1,0,0|2,0,0]=4 394 B16R2.24 Cc1c(cccc1c2ccccc2)C=O 4afadea9f8b2ead87460e11d6f2e4a08 [0,0,1,1,0,0|1,0,1]=4 395 B16R2.24 Cc1c(cccc1c2ccccc2)CO f0ace42b2a3c5304b2a4085ef09778c7 [0,0,1,1,0,0|1,0,1]=4 396 B16R2.24 Nc1c(cccc1c2ccccc2)C=O 365e151034110bd468e51aab1c231ac0 [0,0,1,1,0,0|1,0,1]=4 397 B16R2.24 Nc1c(cccc1c2ccccc2)CO c0f8a3684201d2b126f39267748e47a3 [0,0,1,1,0,0|1,0,1]=4 398 B16R2.24 O=Cc1cccc(c1Cl)c2ccccc2 fca793b3e42bf508411efbb9d40f9bef [0,0,1,1,0,0|1,0,1]=4 399 B16R2.24 O=Cc1cccc(c1F)c2ccccc2 21da9a0d3a487249525049dd0bd336ae [0,0,1,1,0,0|1,0,1]=4 400 B16R2.24 O=Cc1cccc(c1O)c2ccccc2 0ac9d964def1e9efabd103e453db40cb [0,0,1,1,0,0|0,0,2]=4 401 B16R2.24 OCc1cccc(c1Cl)c2ccccc2 d9a0bf60539573fb046a89b3b975e64c [0,0,1,1,0,0|1,0,1]=4 402 B16R2.24 OCc1cccc(c1F)c2ccccc2 3486ee26d53824ebfe6708021c0b368c [0,0,1,1,0,0|1,0,1]=4 403 B16R2.24 OCc1cccc(c1O)c2ccccc2 193916c06bf67a63b06cf6efd1d52f91 [0,0,1,1,0,0|0,0,2]=4 404 B16R2.187 O=CN(c1ccccc1)c2ccccn2 b8ac0c51c262368d0bc0e3293bb9d5f7 [0,0,1,1,0,0|2,0,0]=4 405 B16R2.187 O=CN(c1ccccc1)c2cccnc2 9d4e2926b15db5fcd5386a914242676a [0,0,1,1,0,0|2,0,0]=4 406 B16R2.9360 Cc1ccc(c(c1C=O)c2ccco2)O 369575603c95dd56a7e5b9dd1936c9d8 [0,0,1,1,0,0|1,0,1]=4 407 B16R2.9360 Cc1ccc(c(c1c2ccco2)C=O)Cl 0860d7de743e8693b132704ece1010cd [0,0,1,1,0,0|1,0,1]=4 408 B16R2.9360 Cc1ccc(c(c1c2ccco2)C=O)F a6da55b8e74ddf490748ab2d01755ee3 [0,0,1,1,0,0|1,0,1]=4 409 B16R2.9360 Cc1ccc(c(c1c2ccco2)C=O)O 09f0da6b70ed85c4bf4c7342c4c70b78 [0,0,1,1,0,0|1,0,1]=4 410 B16R2.9360 O=Cc1c(ccc(c1c2ccco2)Cl)F e549e9d32ff930161a19cb2e4a614dfb [0,0,1,1,0,0|2,0,0]=4 411 B16R2.9360 O=Cc1c(ccc(c1c2ccco2)F)F 8d9c85e26edad1d44068bfa0bc4a6253 [0,0,1,1,0,0|2,0,0]=4 412 B16R2.9360 O=Cc1c(ccc(c1c2ccco2)F)O 590a02bcefdbcdf02e60d6891f8f2aec [0,0,1,1,0,0|2,0,0]=4 413 B16R2.9360 O=Cc1c(ccc(c1c2ccco2)O)F 5f9f8ec017a75cda0483b208c4afd801 [0,0,1,1,0,0|2,0,0]=4 414 B16R2.9360 O=Cc1c(ccc(c1c2ccco2)O)O a3a4adcc87a15786ff8ae3391965aa28 [0,0,1,1,0,0|2,0,0]=4 415 B16R2.37063 COc1cccc(c1c2ccco2)C=O 5e3ded32d784c7c7aa89cfa28a22244b [0,0,1,1,0,0|1,0,1]=4 416 B16R2.37063 CSc1cccc(c1c2ccco2)C=O 1f2195c618d4c5d6031f868f5b36d04b [0,0,1,1,0,0|1,0,1]=4 417 B16R2.37063 N#Cc1cccc(c1c2ccco2)C=O 5545ada1381b6793292fc5c365028274 [0,0,1,1,0,0|1,0,1]=4 418 B16R2.37063 O=Cc1cccc(c1c2ccc[nH]2)C=O bebd7c28372278a37a242a9d08f73302 [0,0,1,1,0,0|2,0,0]=4 419 B16R2.37063 O=Cc1cccc(c1c2ccco2)C=O ff4c8c8025344c1b4c620d241d7db82a [0,0,1,1,0,0|1,0,0]=3 420 B16R2.37063 O=Cc1cccc(c1c2cccs2)C=O 47b15f94761df143074c34378e250306 [0,0,1,1,0,0|1,1,0]=4 421 B16R2.37063 O=Cc1cccc(c1c2ccno2)C=O 30f4fd09d44b7bee3976370efcb4fa7a [0,0,1,1,0,0|2,0,0]=4 422 B16R2.37063 O=Cc1cccc(c1c2cnco2)C=O 6772d056bfb961d183a4a9f8ba4a0524 [0,0,1,1,0,0|2,0,0]=4 423 B16R2.37063 O=Cc1cccc(c1c2ncco2)C=O b8f533a7f7323a270539403e94addd65 [0,0,1,1,0,0|2,0,0]=4 424 B16R2.94 C=CCc1cccc(c1)c2ccccc2 802c85a9b981b439bba591833806111d [0,0,1,1,0,0|2,0,0]=4 425 B16R2.94 C=CCc1cncc(c1)c2ccccc2 fb278ed13ad1bfc93a900e34f7228a6a [0,0,1,1,0,0|2,0,0]=4 426 B16R2.2279 C=Cc1ccc(cc1F)c2ccccc2 302a919b913ffc248bc70a2caecbaaff [0,0,1,1,0,0|2,0,0]=4 427 B16R2.2279 C=Cc1ccc(cc1O)c2ccccc2 cf31461288885702fa615ffaa82bb864 [0,0,1,1,0,0|1,0,0]=3 428 B16R2.2279 C=Cc1ccc(cc1O)c2ccccn2 1ed45fc00e34c3919655ace10f7587fb [0,0,1,1,0,0|2,0,0]=4 429 B16R2.2279 C=Cc1ccc(cc1O)c2cccnc2 ea86d184cdfab9a89c9326e9628304e0 [0,0,1,1,0,0|2,0,0]=4 430 B16R2.2279 C=Cc1ccc(cc1O)c2ccncc2 33c58ac28306c0c0eb618780b5475345 [0,0,1,1,0,0|2,0,0]=4 431 B16R2.2279 O=Cc1ccc(cc1O)c2ccccc2 2294560af9832682a1de8af3a2843f79 [0,0,1,1,0,0|2,0,0]=4 432 B16R2.2279 O=Cc1ncc(cc1O)c2ccccc2 245ff1e35b619768cf8882943521dbf2 [0,0,1,1,0,0|2,0,0]=4 433 B16R2.3814 CCOc1cc(c2ccccc2c1)C=O be55064e8bf386b9f1c148ae7e02d141 [0,0,1,1,0,0|0,0,2]=4 434 B16R2.3814 O=Cc1cc(cc2c1cccc2)OCF 965d3361ff60d051adf21483b86d34bf [0,0,1,1,0,0|1,0,1]=4 435 B16R2.6164 Cc1cc(cc(c1C)c2ccccc2)O dcac0fac1760d5e2cbbdb772436db39c [0,0,1,1,0,0|1,0,1]=4 436 B16R2.6164 Cc1cc(cc(c1F)c2ccccc2)O 5e297f5bc5ca40d08425f63622cfedba [0,0,1,1,0,0|1,0,1]=4 437 B16R2.6164 Cc1cc(cc(c1O)c2ccccc2)O 940f9aca54c265ec800df7e9b0c5807a [0,0,1,1,0,0|0,0,2]=4 438 B16R2.6164 Oc1cc(c(c(c1)c2ccccc2)F)Cl d4a4c212fd1a1777f0e3c27da32941df [0,0,1,1,0,0|2,0,0]=4 439 B16R2.6164 Oc1cc(c(c(c1)c2ccccc2)F)F 4d9b531bec28cb061475b4d1081a0739 [0,0,1,1,0,0|2,0,0]=4 440 B16R2.6164 Oc1cc(c(c(c1)c2ccccc2)O)F 8c08d3ee2a5c7c44a0f8bc20241c93ab [0,0,1,1,0,0|1,0,1]=4 441 B16R2.1955 C=Cc1cccc(c1OC)c2ccco2 2c972d3237a6de940f17ce286496e134 [0,0,1,1,0,0|2,0,0]=4 442 B16R2.1955 COc1cccc(c1C=O)c2ccco2 ef4ed4c6d296c1277dbda5473f91a702 [0,0,1,1,0,0|1,0,1]=4 443 B16R2.1955 CSc1cccc(c1C=O)c2ccco2 c283183f7c706843b2e851b81cf230fd [0,0,1,1,0,0|1,0,1]=4 444 B16R2.1955 N#Cc1cccc(c1C=O)c2ccco2 cf4c82ce3b14568a6e8c72fb70af670a [0,0,1,1,0,0|1,0,1]=4 445 B16R2.1955 O=Cc1cccc(c1C=O)c2ccc[nH]2 9071c3d1b2b3a0d87205b319add452b1 [0,0,1,1,0,0|2,0,0]=4 446 B16R2.1955 O=Cc1cccc(c1C=O)c2ccco2 be71dc98cba9b1c6e18678e6e1d181ad [0,0,1,1,0,0|1,0,0]=3 447 B16R2.1955 O=Cc1cccc(c1C=O)c2cccs2 e222fdfd945114c8f73a7e4da92df819 [0,0,1,1,0,0|1,1,0]=4 448 B16R2.1955 O=Cc1cccc(c1C=O)c2cnco2 9e5bae5451c813e1516da8c314fe8075 [0,0,1,1,0,0|2,0,0]=4 449 B16R2.27 C=Cc1ccc(c(c1)c2ccccc2)C 6d6afc6efec0fa37d7eada72c27ff2d4 [0,0,1,1,0,0|2,0,0]=4 450 B16R2.27 C=Cc1ccc(c(c1)c2ccccc2)F d8dac38b1f647d26df07d88ceea6f79f [0,0,1,1,0,0|2,0,0]=4 451 B16R2.27 C=Cc1ccc(c(c1)c2ccccc2)O 6e26399434c62135faf5928035ef0f40 [0,0,1,1,0,0|1,0,1]=4 452 B16R2.27 COc1ccc(c(c1)c2ccccc2)Br 1f98194265218660919cc684b4841441 [0,0,1,1,0,0|1,0,1]=4 453 B16R2.27 COc1ccc(c(c1)c2ccccc2)C 7c3b22cc2bd49140575c5f1e4f86d1b8 [0,0,1,1,0,0|1,0,1]=4 454 B16R2.27 COc1ccc(c(c1)c2ccccc2)Cl 7e26c9b8011c0c7e43cb5ffe965ec482 [0,0,1,1,0,0|1,0,1]=4 455 B16R2.27 COc1ccc(c(c1)c2ccccc2)F 0f0f9b64cec6af9f2ea7b4fc99d39380 [0,0,1,1,0,0|1,0,1]=4 456 B16R2.27 COc1ccc(c(c1)c2ccccc2)I 9c0e4dae3ee8c613a040710730fd06fe [0,0,1,1,0,0|1,0,1]=4 457 B16R2.27 COc1ccc(c(c1)c2ccccc2)N 8d23315ef08a561ca8db45b13b7f1fb6 [0,0,1,1,0,0|1,0,1]=4 458 B16R2.27 COc1ccc(c(c1)c2ccccc2)O 917e054e823c8444d19693cd20a88719 [0,0,1,1,0,0|0,0,2]=4 459 B16R2.27 COc1ccc(c(c1)c2ccccc2)S 1dcd1a01acdf439862f0d137694feb23 [0,0,1,1,0,0|0,1,1]=4 460 B16R3.5988 c1ccc(cc1)c2cc3ccsc3s2 cf25faf144e3dabac4849057520351d9 [1,0,0,1,0,0|1,1,0]=4 461 B16R3.5988 c1ccc(cc1)c2cc3sccc3s2 180462dcd4034a1c7557aae352a63b55 [1,0,0,1,0,0|0,2,0]=4 462 B16R3.8 c1c[nH]c(c1)c2c[nH]c3c2cccc3 808ce16a9613b0b12f1ce2650e72dd2e [0,0,0,1,1,0|2,0,0]=4 463 B16R3.8 c1c[nH]c(c1)c2coc3c2cccc3 2b2d53e5594a5d711e2e2fdc37fd4c52 [0,0,0,1,1,0|1,0,1]=4 464 B16R3.8 c1c[nH]c(c1)c2csc3c2cccc3 c8e81df0f4d1ec3d7d9099f7ea91f789 [0,0,0,1,1,0|1,1,0]=4 465 B16R3.8 c1ccc2c(c[nH]c2c1)c3ccno3 c814bde7e750be8d73727da0f8ea42d7 [0,0,0,1,1,0|2,0,0]=4 466 B16R3.8 c1ccc2c(c[nH]c2c1)c3cnco3 0142b1944eaa41046e6bba9f99a3cc99 [0,0,0,1,1,0|2,0,0]=4 467 B16R3.8 c1ccc2c(c[nH]c2c1)c3ncco3 9eea95b37b2df0d0b583b166ab0ab208 [0,0,0,1,1,0|2,0,0]=4 468 B16R3.8 c1ccc2c(coc2c1)c3ccno3 3cdd779ce5476dc07bc4dd9780178103 [0,0,0,1,1,0|1,0,1]=4 469 B16R3.8 c1ccc2c(coc2c1)c3cnco3 b6d2ffe5ab0291fc01c29c7da9b18ea9 [0,0,0,1,1,0|1,0,1]=4 470 B16R3.8 c1ccc2c(coc2c1)c3ncco3 b610fd218849a57499516008989b5d92 [0,0,0,1,1,0|1,0,1]=4 471 B16R3.8 c1ccc2c(csc2c1)c3ccno3 9e672cfcc2d9a5bd2584f2c13e6ce8ad [0,0,0,1,1,0|1,1,0]=4 472 B16R3.8 c1ccc2c(csc2c1)c3cnco3 dd76d7a1cc3769484db3c9b3bda6c3eb [0,0,0,1,1,0|1,1,0]=4 473 B16R3.8 c1ccc2c(csc2c1)c3ncco3 7516183779745d4a78c3ff8a6d5c97e7 [0,0,0,1,1,0|1,1,0]=4 474 B16R3.8 c1coc(c1)c2c[nH]c3c2cccc3 f5145e91e499154587aeedfe8331ed15 [0,0,0,1,1,0|1,0,0]=3 475 B16R3.8 c1coc(c1)c2c[nH]c3c2cccn3 702f2ed202f90d8ca8fc10ea37361b7e [0,0,0,1,1,0|2,0,0]=4 476 B16R3.8 c1coc(c1)c2c[nH]c3c2ccnc3 f24207216e1dea3a3d9acdb0f136f563 [0,0,0,1,1,0|2,0,0]=4 477 B16R3.8 c1coc(c1)c2c[nH]c3c2cncc3 1acdbafd1fa76d64d2be1e1ef04bbe15 [0,0,0,1,1,0|2,0,0]=4 478 B16R3.8 c1coc(c1)c2c[nH]c3c2nccc3 b71b2e1b55c23d3cda3a5b96dc593820 [0,0,0,1,1,0|2,0,0]=4 479 B16R3.8 c1coc(c1)c2cnc3n2cccc3 ad5753cde0aff5c58dd578c1d5c65d5a [0,0,0,1,1,0|2,0,0]=4 480 B16R3.8 c1coc(c1)c2cnn3c2cccc3 8b4cba4c68a124508a0444e63cec3c83 [0,0,0,1,1,0|2,0,0]=4 481 B16R3.8 c1coc(c1)c2coc3c2cccc3 e3d8763cee1ae880d49e26c3262e7e2b [0,0,0,1,1,0|0,0,1]=3 482 B16R3.8 c1coc(c1)c2coc3c2cccn3 1581c2c94f5ff70f67354d17479e5958 [0,0,0,1,1,0|1,0,1]=4 483 B16R3.8 c1coc(c1)c2coc3c2cncc3 0a7904045e954ff9aee0200c8f697d61 [0,0,0,1,1,0|1,0,1]=4 484 B16R3.8 c1coc(c1)c2coc3c2nccc3 cfde68542926a6da93b408076710037f [0,0,0,1,1,0|1,0,1]=4 485 B16R3.8 c1coc(c1)c2csc3c2cccc3 833e663ebc53d5b11fde6fea32e33d84 [0,0,0,1,1,0|0,1,0]=3 486 B16R3.8 c1coc(c1)c2csc3c2cccn3 d81a9d2fcbe87f6f46117448386dd51b [0,0,0,1,1,0|1,1,0]=4 487 B16R3.8 c1coc(c1)c2csc3c2ccnc3 eda5f01e217dad1f5fac2128eb86c902 [0,0,0,1,1,0|1,1,0]=4 488 B16R3.8 c1coc(c1)c2csc3c2cncc3 94dfc792dcf2bc3999f0ecd6a18f53c7 [0,0,0,1,1,0|1,1,0]=4 489 B16R3.8 c1coc(c1)c2csc3c2nccc3 c5667171544bff21916751e9c38368e7 [0,0,0,1,1,0|1,1,0]=4 490 B16R3.8 c1coc(c1)c2n[nH]c3c2cccc3 aea647f411bc1924a3a7e244d0318aec [0,0,0,1,1,0|2,0,0]=4 491 B16R3.8 c1coc(c1)c2noc3c2cccc3 e8cb8b08adb5754fc4239ed705c34d87 [0,0,0,1,1,0|1,0,1]=4 492 B16R3.8 c1coc(c1)c2nsc3c2cccc3 a81bd0ef0bf9e18df91b1a0de79d1718 [0,0,0,1,1,0|1,1,0]=4 493 B16R3.8 c1coc(c1)n2cnc3c2cccc3 d51a1d9683901c487630d24e1ba60894 [0,0,0,1,1,0|2,0,0]=4 494 B16R3.8 c1csc(c1)c2c[nH]c3c2cccc3 1353c2ab401df970e76f6d850291e117 [0,0,0,1,1,0|1,1,0]=4 495 B16R3.8 c1csc(c1)c2coc3c2cccc3 7552b7fac56038dbfad3938cc99bd478 [0,0,0,1,1,0|0,1,1]=4 496 B16R3.8 c1csc(c1)c2csc3c2cccc3 3046c6677474e0ff470c1124ee35f5a0 [0,0,0,1,1,0|0,2,0]=4 497 B16R3.1795 c1ccc(cc1)c2coc3c2scc3 fe8ba3d5ef1c6729d45200d5276bf5fc [0,0,0,1,1,0|0,1,1]=4 498 B16R3.1795 c1ccc(cc1)c2csc3c2scc3 86fa6af97028d57887833eb6a9f38687 [0,0,0,1,1,0|0,2,0]=4 499 B16R3.1779 c1c[nH]c(c1)c2ccc3ccoc3c2 990b07b742c870c39f1e3d36febab273 [0,0,0,1,1,0|2,0,0]=4 500 B16R3.1779 c1c[nH]c(c1)c2cnc3ccoc3c2 14a90df530ee832eb3d3a3ed507333c7 [0,0,0,1,1,0|2,0,0]=4 501 B16R3.1779 c1cc(c[nH]1)c2ccc3ccoc3c2 67b0351191f12b72129defaef5053750 [0,0,0,1,1,0|2,0,0]=4 502 B16R3.1779 c1cc(c[nH]1)c2cnc3ccoc3c2 984e3181b2d6d577836e9859662e93fa [0,0,0,1,1,0|2,0,0]=4 503 B16R3.1779 c1cc(co1)c2ccc3ccoc3c2 85c3cef42be6eec144a08aa8c7979fa6 [0,0,0,1,1,0|2,0,0]=4 504 B16R3.1779 c1cc(co1)c2cnc3ccoc3c2 aeaae77a483c0d12de6e3aea69f8cf1f [0,0,0,1,1,0|2,0,0]=4 505 B16R3.1779 c1cc2ccc(cc2o1)c3ccsc3 1d32676e4dd5acb8386c1d83475c590e [0,0,0,1,1,0|2,0,0]=4 506 B16R3.1779 c1cc2ncc(cc2o1)c3ccsc3 c2dd8f9eaae0bddd384ed0be1229dc44 [0,0,0,1,1,0|2,0,0]=4 507 B16R3.1779 c1coc(c1)c2ccc3ccoc3c2 300c06e759a1e4a67b9e12509cf3abeb [0,0,0,1,1,0|2,0,0]=4 508 B16R3.1779 c1coc(c1)c2cnc3ccoc3c2 2342d3bd037717cd4ede766bb5af8266 [0,0,0,1,1,0|2,0,0]=4 509 B16R3.1779 c1csc(c1)c2ccc3ccoc3c2 a334e502479d515281d4631e380eee54 [0,0,0,1,1,0|2,0,0]=4 510 B16R3.1779 c1csc(c1)c2cnc3ccoc3c2 f8431df645954ade60f130294b19fd6c [0,0,0,1,1,0|2,0,0]=4 511 B16R3.1796 C1=Cc2c1ccc(c2)c3ccccc3 09dc6d3dc53c6eb5dcd912de29996f4a [0,0,0,1,1,0|1,0,0]=3 512 B16R3.1796 C1=Cc2c1ccc(c2)c3ccccn3 def2a5a82a150073ed2c26c43164e888 [0,0,0,1,1,0|2,0,0]=4 513 B16R3.1796 C1=Cc2c1ccc(c2)c3cccnc3 8fae0e20c92f143bf2c86fd8331a07cc [0,0,0,1,1,0|2,0,0]=4 514 B16R3.1796 C1=Cc2c1ccc(c2)c3ccncc3 ea4e0a003a6bb9a9388858ec7dc9881a [0,0,0,1,1,0|2,0,0]=4 515 B18R3.2123 C1=Cc2cc(ccc2OC1)c3ccccc3 b80557f3330e94cba556f9272a3ae8f1 [0,0,0,1,0,1|1,0,1]=4 516 B18R3.2123 c1ccc(cc1)c2ccc3ccccc3c2 4ba1e9bce66f5eacac09ba631e649f88 [0,0,0,1,0,1|2,0,0]=4 517 B18R3.2123 c1ccc(cc1)c2ccc3cccnc3c2 d8a6ac8390605e15e60343fce0ec2ca1 [0,0,0,1,0,1|2,0,0]=4 518 B18R3.2123 c1ccc(cc1)c2ccc3ccncc3c2 3051c54aeac8c0c521a961faf4641b2e [0,0,0,1,0,1|2,0,0]=4 519 B18R3.2123 c1ccc(cc1)c2ccc3ccnnc3c2 7d9f42fd1bc946f5b8743cba091db57e [0,0,0,1,0,1|2,0,0]=4 520 B18R3.2123 c1ccc(cc1)c2ccc3cnccc3c2 406226cd282eab2374c6f30e8c0e57eb [0,0,0,1,0,1|2,0,0]=4 521 B18R3.2123 c1ccc(cc1)c2ccc3cncnc3c2 dd42f3cb72844797cb6e0146ec1482f4 [0,0,0,1,0,1|2,0,0]=4 522 B18R3.2123 c1ccc(cc1)c2ccc3ncccc3c2 5722fd6d49c5661f75b59e0a940318e4 [0,0,0,1,0,1|2,0,0]=4 523 B18R3.2123 c1ccc(cc1)c2ccc3nccnc3c2 ff9cb45790c781d3da88d5d4b836fcb1 [0,0,0,1,0,1|2,0,0]=4 524 B18R3.2123 c1ccc(cc1)c2cnc3ccccc3c2 87d888249961b804ad72f5643cb3ddc8 [0,0,0,1,0,1|2,0,0]=4 525 B18R3.2123 c1ccc(cc1)c2cnc3cccnc3c2 f6290112a941ef9958173465fd86b40f [0,0,0,1,0,1|2,0,0]=4 526 B18R3.2123 c1ccc(cc1)c2cnc3ccncc3c2 4f606f078f9abae83af0ee316d6a41aa [0,0,0,1,0,1|2,0,0]=4 527 B18R3.2123 c1ccc(cc1)c2cnc3ncccc3c2 bfc1e097fad8f69b4190c070b1b26227 [0,0,0,1,0,1|2,0,0]=4 528 B18R3.2123 c1ccc(cc1)c2cnc3nccnc3c2 42a7b5f0923dba901ca7ee66bc2875eb [0,0,0,1,0,1|2,0,0]=4 529 B18R3.112 O=C1c2ccccc2CC1Oc3ccco3 a47b697207f2550b079b827192856c1b [0,0,0,1,0,1|1,0,1]=4 530 B18R3.311 C=Cc1nc2ccccc2n1c3ccco3 f18bb1e867339897509a101044574d01 [0,0,0,1,0,1|2,0,0]=4 531 B18R3.311 CCc1sc2ccccc2c1c3ccco3 036e9e8021cf60059787dd0ce191fef7 [0,0,0,1,0,1|1,0,1]=4 532 B18R3.311 CSc1oc2ccccc2c1c3ccco3 138cbe763a0d66a7d4ed5523a3aa5074 [0,0,0,1,0,1|2,0,0]=4 533 B18R3.311 CSc1sc2ccccc2c1c3ccco3 ee573134736ac9ac926d2d931e830c08 [0,0,0,1,0,1|2,0,0]=4 534 B18R3.311 ClCc1sc2ccccc2c1c3ccco3 089e48e43ce73abcbb27fbff7d9dee1c [0,0,0,1,0,1|1,0,1]=4 535 B18R3.311 N#Cc1[nH]c2ccccc2c1c3ccco3 7e2b7288018c5252a354b215ef827854 [0,0,0,1,0,1|1,0,1]=4 536 B18R3.311 N#Cc1sc2ccccc2c1c3ccco3 1aca940bf998d4da8d61fd09c5f05c6c [0,0,0,1,0,1|1,0,1]=4 537 B18R3.311 O=Cc1[nH]c2ccccc2c1c3cc[nH]c3 5026b61f058e196374e77e240b94f87b [0,0,0,1,0,1|2,0,0]=4 538 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ccc[nH]3 997777ea5a5647935e9e344621a9cf12 [0,0,0,1,0,1|1,0,0]=3 539 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ccco3 b008cfa8100bc70576d83a781ec8e1be [0,0,0,1,0,1|0,0,0]=2 540 B18R3.311 O=Cc1[nH]c2ccccc2c1c3cccs3 17c72b7d5e0e5d17e1b5ef0d86e81ff6 [0,0,0,1,0,1|0,1,0]=3 541 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ccn[nH]3 d3cc5f41f48f83a774319b1935c69cfe [0,0,0,1,0,1|2,0,0]=4 542 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ccns3 3638655c83b49135c233c76e6d525f99 [0,0,0,1,0,1|1,1,0]=4 543 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ccoc3 2c50d039631c6b8f7a65ba279cf33953 [0,0,0,1,0,1|2,0,0]=4 544 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ccsc3 caad5ec9089e45f4f77050b3c9c7b230 [0,0,0,1,0,1|2,0,0]=4 545 B18R3.311 O=Cc1[nH]c2ccccc2c1c3cncs3 772d0b0bd44824ed19c3dc8b5104138c [0,0,0,1,0,1|1,1,0]=4 546 B18R3.311 O=Cc1[nH]c2ccccc2c1c3cocn3 12f2f196c52adedf67857cd0b92d09ce [0,0,0,1,0,1|2,0,0]=4 547 B18R3.311 O=Cc1[nH]c2ccccc2c1c3cscn3 97f2028310da6b41447147aa47724505 [0,0,0,1,0,1|2,0,0]=4 548 B18R3.311 O=Cc1[nH]c2ccccc2c1c3ncc[nH]3 93ce708c1a6c5cffcb4893312e19aad3 [0,0,0,1,0,1|2,0,0]=4 549 B18R3.311 O=Cc1[nH]c2ccccc2c1c3nccs3 3acf259390e7b239bb8a58242b6c1719 [0,0,0,1,0,1|1,1,0]=4 550 B18R3.311 O=Cc1[nH]c2ccccc2c1c3nnco3 821dc66891bd507d484eb28c63b6873b [0,0,0,1,0,1|2,0,0]=4 551 B18R3.311 O=Cc1cc2ccccc2n1c3ccco3 b0d8e3b5dc793f8ba7112023ddebaacb [0,0,0,1,0,1|1,0,0]=3 552 B18R3.311 O=Cc1cc2ccccc2n1c3ncco3 7b52510c4385acd43a1f6a76b6295f6d [0,0,0,1,0,1|2,0,0]=4 553 B18R3.311 O=Cc1cc2cccnc2n1c3ccco3 bf69a980f8575a5b6eea48d40138309d [0,0,0,1,0,1|2,0,0]=4 554 B18R3.311 O=Cc1cc2ccncc2n1c3ccco3 38259dd4b3e0b64a31c44c56f23937e8 [0,0,0,1,0,1|2,0,0]=4 555 B18R3.311 O=Cc1cc2cnccc2n1c3ccco3 b4209307b8af143f92c0131032641e47 [0,0,0,1,0,1|2,0,0]=4 556 B18R3.311 O=Cc1cc2ncccc2n1c3ccco3 49f1fb61b287b8a63a1ece17c4476458 [0,0,0,1,0,1|2,0,0]=4 557 B18R3.311 O=Cc1nc2ccccc2n1c3ccco3 8009b4bc4fff90a4a42adb32eea3e399 [0,0,0,1,0,1|1,0,0]=3 558 B18R3.311 O=Cc1nc2ccccc2n1c3ncco3 ffc59f7773ddc12f13c5810a7db16679 [0,0,0,1,0,1|2,0,0]=4 559 B18R3.311 O=Cc1nc2ccccn2c1c3ccc[nH]3 95f1d5f7923f3f71f62693dc2b850be4 [0,0,0,1,0,1|2,0,0]=4 560 B18R3.311 O=Cc1nc2ccccn2c1c3ccco3 d9d73de2ffd38102ea94c80e9e6e5b2b [0,0,0,1,0,1|1,0,0]=3 561 B18R3.311 O=Cc1nc2ccccn2c1c3cccs3 9fdebdaa8c13ff4f9dec98f52dc49872 [0,0,0,1,0,1|1,1,0]=4 562 B18R3.311 O=Cc1nc2ccccn2c1c3cnco3 dd018bcd452edb08ea1efb66621347d6 [0,0,0,1,0,1|2,0,0]=4 563 B18R3.311 O=Cc1nc2ncccn2c1c3ccco3 4836d0cfd7d6dc8000ecdba96f18590c [0,0,0,1,0,1|2,0,0]=4 564 B18R3.311 O=Cc1oc2ccccc2c1c3cc[nH]c3 c75e08dc3cd46c635d57a5dfb468f57b [0,0,0,1,0,1|2,0,0]=4 565 B18R3.311 O=Cc1oc2ccccc2c1c3ccc[nH]3 ea0c7c97fb39652e7a9afc65aa22e0eb [0,0,0,1,0,1|1,0,0]=3 566 B18R3.311 O=Cc1oc2ccccc2c1c3ccco3 a163f11a71398e00a7a673dd861a6013 [0,0,0,1,0,1|0,0,0]=2 567 B18R3.311 O=Cc1oc2ccccc2c1c3cccs3 c42185a9afbc77d76032f428990572cf [0,0,0,1,0,1|0,1,0]=3 568 B18R3.311 O=Cc1oc2ccccc2c1c3ccn[nH]3 2276f3b3373ad50a5513e080d93b9d15 [0,0,0,1,0,1|2,0,0]=4 569 B18R3.311 O=Cc1oc2ccccc2c1c3ccns3 59cc59f58a8d3f0a102d2eb9ac212f26 [0,0,0,1,0,1|1,1,0]=4 570 B18R3.311 O=Cc1oc2ccccc2c1c3ccoc3 c1aadf211a3914324babbb4510ab082a [0,0,0,1,0,1|2,0,0]=4 571 B18R3.311 O=Cc1oc2ccccc2c1c3ccsc3 c0e9bdbeaab4d6077ba2a48da1768133 [0,0,0,1,0,1|2,0,0]=4 572 B18R3.311 O=Cc1oc2ccccc2c1c3cnco3 41141aadb0cc2b1b0c9d1bc6cba61650 [0,0,0,1,0,1|1,0,0]=3 573 B18R3.311 O=Cc1oc2ccccc2c1c3cncs3 5850be4e9a5c66028312fb7c8fe19e02 [0,0,0,1,0,1|1,1,0]=4 574 B18R3.311 O=Cc1oc2ccccc2c1c3cocn3 4e926d8947d8643d83152aa5a70d1987 [0,0,0,1,0,1|2,0,0]=4 575 B18R3.311 O=Cc1oc2ccccc2c1c3cscn3 55ebef2c6adacc6122877af20b4670c2 [0,0,0,1,0,1|2,0,0]=4 576 B18R3.311 O=Cc1oc2ccccc2c1c3ncc[nH]3 4195e9be3e4a1e517a5ec4c5dcae43bf [0,0,0,1,0,1|2,0,0]=4 577 B18R3.311 O=Cc1oc2ccccc2c1c3nccs3 01dad0bf2da992d7bfd932db500730a7 [0,0,0,1,0,1|1,1,0]=4 578 B18R3.311 O=Cc1oc2ccccc2c1c3nnco3 2c4a2edc6d4d3b1cb34eed7bb420b64a [0,0,0,1,0,1|2,0,0]=4 579 B18R3.311 O=Cc1oc2ccccc2c1n3cccc3 d0a783292727f246c40a2eb720e856d4 [0,0,0,1,0,1|2,0,0]=4 580 B18R3.311 O=Cc1oc2ccccc2c1n3cccn3 e268f7f6b1807bb698bd35b40ecbbb39 [0,0,0,1,0,1|2,0,0]=4 581 B18R3.311 O=Cc1sc2ccccc2c1c3c[nH]cn3 6b54dc7b6eea1fb052602198023ba7fe [0,0,0,1,0,1|2,0,0]=4 582 B18R3.311 O=Cc1sc2ccccc2c1c3cc[nH]c3 a9f294ad3c646a35d0bbd70be97c95fd [0,0,0,1,0,1|2,0,0]=4 583 B18R3.311 O=Cc1sc2ccccc2c1c3ccc[nH]3 55d660e668324e374e48e5b5dda91e35 [0,0,0,1,0,1|1,0,0]=3 584 B18R3.311 O=Cc1sc2ccccc2c1c3ccco3 caa22abdfe42cb488f85b2baca371632 [0,0,0,1,0,1|0,0,0]=2 585 B18R3.311 O=Cc1sc2ccccc2c1c3cccs3 5fe1f8aa003edf150ef97ab9f4448f7e [0,0,0,1,0,1|0,1,0]=3 586 B18R3.311 O=Cc1sc2ccccc2c1c3ccn[nH]3 ff1dc92353ba26ab66dad5d1c1b646cd [0,0,0,1,0,1|2,0,0]=4 587 B18R3.311 O=Cc1sc2ccccc2c1c3ccno3 b1092acc3f08a3a9723fd867ef7f382d [0,0,0,1,0,1|1,0,0]=3 588 B18R3.311 O=Cc1sc2ccccc2c1c3ccns3 cd41b2f78e588497284a0e60de43b870 [0,0,0,1,0,1|1,1,0]=4 589 B18R3.311 O=Cc1sc2ccccc2c1c3ccoc3 fcde02f463994e8857cca5568f818426 [0,0,0,1,0,1|2,0,0]=4 590 B18R3.311 O=Cc1sc2ccccc2c1c3ccon3 af719fc94a0e69cc8c6ee6cf5a52943a [0,0,0,1,0,1|2,0,0]=4 591 B18R3.311 O=Cc1sc2ccccc2c1c3ccsc3 cc54495eafc05b97ba957ee1ef6964ea [0,0,0,1,0,1|2,0,0]=4 592 B18R3.311 O=Cc1sc2ccccc2c1c3ccsn3 5035cdb80c8f4c3f4afa700272701fe2 [0,0,0,1,0,1|2,0,0]=4 593 B18R3.311 O=Cc1sc2ccccc2c1c3cnco3 aec8df19858178dfe3dfdbff17de6db3 [0,0,0,1,0,1|1,0,0]=3 594 B18R3.311 O=Cc1sc2ccccc2c1c3cncs3 007c1ee6c38a7b49fa42eec9f5a446db [0,0,0,1,0,1|1,1,0]=4 595 B18R3.311 O=Cc1sc2ccccc2c1c3cocn3 8d736931dc21b1d1b4e8b59f519cd359 [0,0,0,1,0,1|2,0,0]=4 596 B18R3.311 O=Cc1sc2ccccc2c1c3cscn3 2f5359449985cd21709f932a4d5621f8 [0,0,0,1,0,1|2,0,0]=4 597 B18R3.311 O=Cc1sc2ccccc2c1c3ncc[nH]3 fdab2b4f1fd057e71e4f5943c5921851 [0,0,0,1,0,1|2,0,0]=4 598 B18R3.311 O=Cc1sc2ccccc2c1c3ncco3 46498d3f020608c25dd44ac47a33f8bf [0,0,0,1,0,1|1,0,0]=3 599 B18R3.311 O=Cc1sc2ccccc2c1c3nccs3 9ab60d2d70aeb3246470a0924d6ccbe8 [0,0,0,1,0,1|1,1,0]=4 600 B18R3.311 O=Cc1sc2ccccc2c1c3nnco3 1474851d4f499aa2a3d88666f92a9837 [0,0,0,1,0,1|2,0,0]=4 601 B18R3.311 O=Cc1sc2cccnc2c1c3ccc[nH]3 6a3dd144f8cfd139e1c402bfd2a75e58 [0,0,0,1,0,1|2,0,0]=4 602 B18R3.311 O=Cc1sc2cccnc2c1c3ccco3 0bf56a952752ca5a8c39a7f417c5c6e9 [0,0,0,1,0,1|1,0,0]=3 603 B18R3.311 O=Cc1sc2cccnc2c1c3cccs3 71ea5369c04ae982d9b77172e686c7bb [0,0,0,1,0,1|1,1,0]=4 604 B18R3.311 OCc1sc2ccccc2c1c3ccco3 d57ff0625053e0ff24c38255c08ac22b [0,0,0,1,0,1|0,0,2]=4 605 B18R3.12792 c1cc(ccn1)Nc2ccc3ccoc3c2 f3819ce5a1b8171f7e62cde255196c61 [0,0,0,1,0,1|2,0,0]=4 606 B18R3.12792 c1cc(ccn1)Nc2cnc3ccoc3c2 fb7e7833c6bf50f397e33f75d5839c22 [0,0,0,1,0,1|2,0,0]=4 607 B18R3.12792 c1ccc(cc1)Nc2ccc3cc[nH]c3c2 d2060503d0bb424432e8e30fb009ecc3 [0,0,0,1,0,1|2,0,0]=4 608 B18R3.12792 c1ccc(cc1)Nc2ccc3ccoc3c2 ac780cc1b27286e577441fa492d6a256 [0,0,0,1,0,1|1,0,0]=3 609 B18R3.12792 c1ccc(cc1)Nc2ccc3ccsc3c2 10d0e44d8685e304c6a7006ef18760ac [0,0,0,1,0,1|1,1,0]=4 610 B18R3.12792 c1ccc(cc1)Nc2ccc3cnoc3c2 7138521f38a36e81aed87ed9ff039047 [0,0,0,1,0,1|2,0,0]=4 611 B18R3.12792 c1ccc(cc1)Nc2ccc3ncoc3c2 d2d728a21c21550b1a2d72638836d51f [0,0,0,1,0,1|2,0,0]=4 612 B18R3.12792 c1ccc(cc1)Nc2cnc3cc[nH]c3c2 e8a7df1fddf9956a0c33268497ed3d92 [0,0,0,1,0,1|2,0,0]=4 613 B18R3.12792 c1ccc(cc1)Nc2cnc3ccoc3c2 000658feeb3d761d65b596e63979deaf [0,0,0,1,0,1|1,0,0]=3 614 B18R3.12792 c1ccc(cc1)Nc2cnc3ccsc3c2 46411b1592ca016480f3154f7c4ae3e5 [0,0,0,1,0,1|1,1,0]=4 615 B18R3.12792 c1ccc(nc1)Nc2ccc3ccoc3c2 0eb0ffea8d604d67657c0f06ed12cb1b [0,0,0,1,0,1|2,0,0]=4 616 B18R3.12792 c1ccc(nc1)Nc2cnc3ccoc3c2 b589610b14ad5a53b67febf8684a1d18 [0,0,0,1,0,1|2,0,0]=4 617 B18R3.12792 c1cncc(c1)Nc2ccc3ccoc3c2 dd42610bcb126b134ee8e4a9fdeff8a6 [0,0,0,1,0,1|2,0,0]=4 618 B18R3.12792 c1cncc(c1)Nc2cnc3ccoc3c2 95613b81f29bf9342e74d0938a33916b [0,0,0,1,0,1|2,0,0]=4 619 B18R3.36580 c1coc(c1)Nc2ccc3ccccc3c2 0d0a3026becc4ee70c2fb58cb0acef7d [0,0,0,1,0,1|2,0,0]=4 620 B18R3.36580 c1coc(c1)Nc2ccc3ccccc3n2 ab2f418a45c695c68150dedf12b534fa [0,0,0,1,0,1|2,0,0]=4 621 B18R3.36580 c1coc(c1)Nc2cnc3ccccc3c2 976ea91c709ea4c43e20ceb076cea347 [0,0,0,1,0,1|2,0,0]=4 622 B18R3.15 c1ccc(cc1)c2cc(n[nH]2)c3ccco3 17eb71f9efc10ff37dc7cbddd06170a1 [0,0,0,1,0,1|2,0,0]=4 623 B18R3.15 c1ccc(cc1)c2cc(no2)c3ccco3 c159abf552a782f7cdd756f189ffe426 [0,0,0,1,0,1|2,0,0]=4 624 B18R3.15 c1ccc(cc1)c2cc(on2)c3ccco3 cba3b7cd3f51e8cb08f5b597455f2706 [0,0,0,1,0,1|1,0,1]=4 625 B18R3.15 c1ccc(cc1)c2cc(sn2)c3ccco3 992c2c72fa7d7603c84ab8d3565bbc2b [0,0,0,1,0,1|1,1,0]=4 626 B18R3.15 c1ccc(cc1)c2ccc(s2)c3ccc[nH]3 4c86eeac43ff6936de4b3f50cdc8f49e [0,0,0,1,0,1|2,0,0]=4 627 B18R3.15 c1ccc(cc1)c2ccc(s2)c3ccco3 e226c308808664089eb1e8141b6ac91e [0,0,0,1,0,1|1,0,0]=3 628 B18R3.15 c1ccc(cc1)c2ccc(s2)c3cccs3 48ece81691c3019b70488c98458985de [0,0,0,1,0,1|1,1,0]=4 629 B18R3.15 c1ccc(cc1)c2ccc(s2)c3ccno3 4735463cba2a252cbf97b4f09be5fdd5 [0,0,0,1,0,1|2,0,0]=4 630 B18R3.15 c1ccc(cc1)c2ccc(s2)c3cnco3 a5ecfd68d61dd294f2c4b43100ffe628 [0,0,0,1,0,1|2,0,0]=4 631 B18R3.15 c1ccc(cc1)c2ccc(s2)c3ncco3 e5656c614903fcb88c329bcc7dc40b35 [0,0,0,1,0,1|2,0,0]=4 632 B18R3.15 c1ccc(cc1)c2cn(cn2)c3ccco3 86900eb2e4c3260f24e244b64328c336 [0,0,0,1,0,1|2,0,0]=4 633 B18R3.15 c1ccc(cc1)c2cnc([nH]2)c3ccc[nH]3 df3ecf028aa0e4a148236c801d537ddb [0,0,0,1,0,1|2,0,0]=4 634 B18R3.15 c1ccc(cc1)c2cnc([nH]2)c3ccco3 46d1f1b3fdf94788a073f19359a10f87 [0,0,0,1,0,1|1,0,0]=3 635 B18R3.15 c1ccc(cc1)c2cnc([nH]2)c3cccs3 086c71b8c407e5b96329bcc7a7b7a260 [0,0,0,1,0,1|1,1,0]=4 636 B18R3.15 c1ccc(cc1)c2cnc([nH]2)c3cnco3 f5d5756016917a36ec2250b742ddf3b9 [0,0,0,1,0,1|2,0,0]=4 637 B18R3.15 c1ccc(cc1)c2cnc(o2)c3ccc[nH]3 17cea8a559fcc4285af6069ee890347a [0,0,0,1,0,1|2,0,0]=4 638 B18R3.15 c1ccc(cc1)c2cnc(o2)c3ccco3 e4e5d1e65b83ae99f69439538f48b488 [0,0,0,1,0,1|1,0,0]=3 639 B18R3.15 c1ccc(cc1)c2cnc(o2)c3cccs3 32797eb813c1b3096dba57dc33ce8fea [0,0,0,1,0,1|1,1,0]=4 640 B18R3.15 c1ccc(cc1)c2cnc(s2)c3ccc[nH]3 e44176c41f2620cd31fd3047dc53539f [0,0,0,1,0,1|2,0,0]=4 641 B18R3.15 c1ccc(cc1)c2cnc(s2)c3ccco3 08f158e1c19e4f2031fccdc522986789 [0,0,0,1,0,1|1,0,0]=3 642 B18R3.15 c1ccc(cc1)c2cnc(s2)c3cccs3 25f025eaabaa00956e9ca0685e496e6e [0,0,0,1,0,1|1,1,0]=4 643 B18R3.15 c1ccc(cc1)c2cnc(s2)c3cnco3 a2cec798b4886b50bcca6617f1e798b5 [0,0,0,1,0,1|2,0,0]=4 644 B18R3.15 c1ccc(cc1)c2cnn(c2)c3ccco3 67f29158ebd4448e424ab81b7bed625e [0,0,0,1,0,1|1,0,0]=3 645 B18R3.15 c1ccc(cc1)c2cnn(c2)c3ncco3 4056eabc41213d07586ad9c7b05ac9b8 [0,0,0,1,0,1|2,0,0]=4 646 B18R3.15 c1ccc(cc1)c2coc(c2)c3ccco3 8c9ac7f2b3930b78b5a107dae13bdd25 [0,0,0,1,0,1|0,0,1]=3 647 B18R3.15 c1ccc(cc1)c2coc(c2)c3cccs3 4585d0e70e60c981989f8d0d74f0cf62 [0,0,0,1,0,1|0,1,1]=4 648 B18R3.15 c1ccc(cc1)c2coc(c2)c3ccno3 5e72e627d6d01b55954da87de8664fe8 [0,0,0,1,0,1|1,0,1]=4 649 B18R3.15 c1ccc(cc1)c2coc(c2)c3ncco3 806cf6ba1db3d79904d7afddf3e6b27c [0,0,0,1,0,1|1,0,1]=4 650 B18R3.15 c1ccc(cc1)c2csc(c2)c3ccc[nH]3 1d7a8d2489c2121df6fcdd5ec49a52fc [0,0,0,1,0,1|1,1,0]=4 651 B18R3.15 c1ccc(cc1)c2csc(c2)c3ccco3 9989f806f15e772222d3b61b73016803 [0,0,0,1,0,1|0,1,0]=3 652 B18R3.15 c1ccc(cc1)c2csc(c2)c3cccs3 e4eb9b65960af498fc2c22da0b6094e0 [0,0,0,1,0,1|0,2,0]=4 653 B18R3.15 c1ccc(cc1)c2csc(c2)c3ccno3 1785cffe0891f9372d590c81bd33dba6 [0,0,0,1,0,1|1,1,0]=4 654 B18R3.15 c1ccc(cc1)c2csc(c2)c3ncco3 0d53a68bd52bb07aeba4e870351bcf9f [0,0,0,1,0,1|1,1,0]=4 655 B18R3.15 c1ccc(cc1)c2csc(n2)c3ccc[nH]3 1775e89e23b98da186edfa87ad7acc30 [0,0,0,1,0,1|1,1,0]=4 656 B18R3.15 c1ccc(cc1)c2csc(n2)c3ccco3 bd246a5986bd39efe46a69d1f4c6c7f6 [0,0,0,1,0,1|0,1,0]=3 657 B18R3.15 c1ccc(cc1)c2csc(n2)c3cccs3 fc8c0a291d8974315df105a20bb817cb [0,0,0,1,0,1|0,2,0]=4 658 B18R3.15 c1ccc(cc1)c2nc(c[nH]2)c3ccco3 d1cba44bb169078eb4b71b72e1cf6fbc [0,0,0,1,0,1|2,0,0]=4 659 B18R3.15 c1ccc(cc1)c2nc(co2)c3ccco3 6ca662baf50da416d91f75d193667a42 [0,0,0,1,0,1|2,0,0]=4 660 B18R3.15 c1ccc(cc1)c2nc(cs2)c3ccco3 d8ff6f10efe86332028d826644c67bd0 [0,0,0,1,0,1|2,0,0]=4 661 B18R3.15 c1ccc(cc1)c2nc(n[nH]2)c3ccco3 9c10d0d93ccf18723f9e0359ef39968f [0,0,0,1,0,1|2,0,0]=4 662 B18R3.15 c1ccc(cc1)c2nc(no2)c3ccco3 61fb9fd982a72a631665250aa479e4bf [0,0,0,1,0,1|2,0,0]=4 663 B18R3.15 c1ccc(cc1)c2ncc(o2)c3ccco3 cbe5c45818b19f84109cdba816137b9d [0,0,0,1,0,1|2,0,0]=4 664 B18R3.15 c1ccc(cc1)c2ncc(s2)c3ccco3 78b030bc6be05b2889700c793f3aedf8 [0,0,0,1,0,1|2,0,0]=4 665 B18R3.15 c1ccc(cc1)c2nnc(o2)c3ccco3 48ecab04c19076e5489bb2af82d4f430 [0,0,0,1,0,1|2,0,0]=4 666 B18R3.15 c1ccc(cc1)c2nnc(s2)c3ccco3 a07d9377a7ccd3b0d525f251106df183 [0,0,0,1,0,1|2,0,0]=4 667 B18R3.15 c1ccc(cc1)c2noc(n2)c3ccco3 8d7d682ba7d054aebe93a8dbab9d04df [0,0,0,1,0,1|1,0,1]=4 668 B18R3.15 c1ccc(cc1)n2ccc(n2)c3ccco3 e5b36d14d7e7aa11792269e9caf6d171 [0,0,0,1,0,1|2,0,0]=4 669 B18R3.15 c1ccc(cc1)n2cnc(c2)c3ccco3 b1bde85d5dcfb92fcf174b2146bd66b6 [0,0,0,1,0,1|2,0,0]=4 670 B18R3.15 c1ccc(nc1)c2ccc(s2)c3ccco3 459d1aa97a44bb65441138206f3d6840 [0,0,0,1,0,1|2,0,0]=4 671 B18R3.15 c1ccc(nc1)c2cnn(c2)c3ccco3 fe8b270dd2bda474ed7c2b9669586efd [0,0,0,1,0,1|2,0,0]=4 672 B18R3.15 c1ccc(nc1)c2csc(n2)c3ccco3 5dcbb4a84c4d6bba08260b84b2044a88 [0,0,0,1,0,1|1,1,0]=4 673 B18R3.15 c1cncc(c1)c2ccc([nH]2)c3ccco3 7ad4135d2fd1c2a78e62813ab1fb6451 [0,0,0,1,0,1|2,0,0]=4 674 B18R3.15 c1cncc(c1)c2ccc(s2)c3ccco3 e2e27a5ac1f811f7d8457ecf6a500fad [0,0,0,1,0,1|2,0,0]=4 675 B18R3.15 c1cncc(c1)c2ccn(c2)c3ccco3 6efaff8dd589189135f80e54bd293d15 [0,0,0,1,0,1|2,0,0]=4 676 B18R3.15 c1cncc(c1)c2cnc([nH]2)c3ccco3 088d931eb1bafa71b5c8f8ede2058b66 [0,0,0,1,0,1|2,0,0]=4 677 B18R3.15 c1cncc(c1)c2cnn(c2)c3ccco3 e733d4e6d316c7e1adf225508d0d9fd1 [0,0,0,1,0,1|2,0,0]=4 678 B18R3.15 c1cncc(c1)c2csc(n2)c3ccco3 5ca1fff245851bd1e553c96c684e768e [0,0,0,1,0,1|1,1,0]=4 679 B18R3.15 c1coc(c1)c2ccc(s2)c3ccncc3 0287e4755937fd9bc322b58e04139979 [0,0,0,1,0,1|2,0,0]=4 680 B18R3.15 c1coc(c1)c2nc(cs2)c3ccncc3 20607850299d3702eee5ba74bfd892df [0,0,0,1,0,1|1,1,0]=4 681 B18R3.15 c1coc(c1)c2ncc(o2)c3ccncc3 4323c3a4c6196bb6555215496ed22037 [0,0,0,1,0,1|2,0,0]=4 682 B18R3.15 c1coc(c1)c2ncc(s2)c3ccncc3 ab0aed8fc34ff0a8474b908638f889da [0,0,0,1,0,1|2,0,0]=4 683 B18R3.15 c1coc(c1)n2cc(cn2)c3ccncc3 b5710f89bc019656be82d9dbcdb0c9b4 [0,0,0,1,0,1|2,0,0]=4 684 B18R3.3347 c1coc(c1)CNc2c[nH]c3c2cccc3 e39f5e380b7db43eae288dc5211ac21e [0,0,0,1,0,1|1,0,1]=4 685 B18R3.3347 c1coc(c1)CNc2coc3c2cccc3 dc6024969fd68f40b181a1e7e02cb4a2 [0,0,0,1,0,1|0,0,2]=4 686 B18R3.3347 c1coc(c1)CNc2csc3c2cccc3 9499e4192b311a0c231706ab64c4dd6b [0,0,0,1,0,1|0,1,1]=4 687 B18R3.3347 c1coc(c1)COc2c[nH]c3c2cccc3 702af089dc51d9b2d72154e92d49f168 [0,0,0,1,0,1|1,0,1]=4 688 B18R3.3347 c1coc(c1)COc2coc3c2cccc3 865cf1a17a3a0e9c7f657b1f2ac1af75 [0,0,0,1,0,1|0,0,2]=4 689 B18R3.3347 c1coc(c1)COc2csc3c2cccc3 ceaed358e9131e6c7f5be2df343ebbcb [0,0,0,1,0,1|0,1,1]=4 690 B18R3.3347 c1coc(c1)NCc2c[nH]c3c2cccc3 c58767fdce8126dfe21b7cb6a5be9061 [0,0,0,1,0,1|1,0,1]=4 691 B18R3.3347 c1coc(c1)NCc2coc3c2cccc3 b40454069b2863f26104a58e7995dcce [0,0,0,1,0,1|0,0,2]=4 692 B18R3.3347 c1coc(c1)NCc2csc3c2cccc3 33e29e26987367aaffb41c30bad3be30 [0,0,0,1,0,1|0,1,1]=4 693 B18R3.3347 c1coc(c1)OCc2coc3c2cccc3 a16d52a1bced22a66e5e499100810e24 [0,0,0,1,0,1|0,0,2]=4 694 B18R3.3347 c1coc(c1)OCc2csc3c2cccc3 1121440b5389d663aa692a7594b93a32 [0,0,0,1,0,1|0,1,1]=4 695 B18R3.4323 Cc1c(ccc2c1cc[nH]2)c3ccccc3 3b412bb234c10137a3afbaf20f623117 [0,0,0,1,0,1|2,0,0]=4 696 B18R3.4323 Cc1c(cnc2c1cc[nH]2)c3ccccc3 1280433d25c21367fa23b37936504dff [0,0,0,1,0,1|2,0,0]=4 697 B18R3.4323 Clc1c(cnc2c1cc[nH]2)c3ccccc3 9ac5a3647af031a89da6c2de548d951a [0,0,0,1,0,1|2,0,0]=4 698 B18R3.4323 Fc1c(ccc2c1cc[nH]2)c3ccccc3 da8dbd9b106cdfed32432da81ce4e8e1 [0,0,0,1,0,1|2,0,0]=4 699 B18R3.4323 Fc1c(cnc2c1cc[nH]2)c3ccccc3 9abb0c6b02df786626b52ba1983846f3 [0,0,0,1,0,1|2,0,0]=4 700 B18R3.4323 Nc1c(ccc2c1nco2)c3ccccc3 7abea72fd8c5f66e5d293756c39f9a1c [0,0,0,1,0,1|2,0,0]=4 701 B18R3.4323 Nc1c(cnc2c1cc[nH]2)c3ccccc3 e0bd07734d4e9cdcf9fa80c48a1ac1fb [0,0,0,1,0,1|2,0,0]=4 702 B18R3.4323 Oc1c(cnc2c1cc[nH]2)c3ccccc3 32c49cf9d33d33efbd02f9fa436ffa37 [0,0,0,1,0,1|1,0,1]=4 703 B18R3.28972 C=Cc1cn(c2c1cccc2)c3ccco3 6c1f96f55784a869e6f71e53936e5266 [0,0,0,1,0,1|1,0,0]=3 704 B18R3.28972 C=Cc1cn(c2c1cccc2)c3cnco3 896b9f7f176ee54519f9cbb4a6f3acfb [0,0,0,1,0,1|2,0,0]=4 705 B18R3.28972 C=Cc1cn(c2c1cccc2)c3ncco3 75c1c67d66526468ffbb3c9f7780926a [0,0,0,1,0,1|2,0,0]=4 706 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3cc[nH]c3 1c393718ebe74c7b727fdf7863ebc45a [0,0,0,1,0,1|2,0,0]=4 707 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ccc[nH]3 181ddc29867b9b6cd17a6e827d13029f [0,0,0,1,0,1|1,0,0]=3 708 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ccco3 8d42818d65cde4e4d08890728bfae1eb [0,0,0,1,0,1|0,0,0]=2 709 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3cccs3 9ea404bd8619040c0fce60b40d274467 [0,0,0,1,0,1|0,1,0]=3 710 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ccn[nH]3 281ab14bccfadb7f2c72e98e20d887a9 [0,0,0,1,0,1|2,0,0]=4 711 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ccns3 f9ef3d1dbf6c040a7d206c7ab7c88805 [0,0,0,1,0,1|1,1,0]=4 712 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ccoc3 a4d90e280269d612b5d320cd8cbbd90a [0,0,0,1,0,1|2,0,0]=4 713 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ccsc3 b37fce4bc3699b28530bd8e20f7ded1f [0,0,0,1,0,1|2,0,0]=4 714 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3cnco3 0af30b96d19b2fb595a946e71e8e3c61 [0,0,0,1,0,1|1,0,0]=3 715 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3cncs3 2e5156d9ee474fbac16ded35c750b3ec [0,0,0,1,0,1|1,1,0]=4 716 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3cocn3 5c937a52614e02b81bac811a506d6185 [0,0,0,1,0,1|2,0,0]=4 717 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3cscn3 e55b5a26736d0d8c39a23d8dc3ccb9d3 [0,0,0,1,0,1|2,0,0]=4 718 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3ncc[nH]3 86c72dc9defc4008f19de3129ecbe993 [0,0,0,1,0,1|2,0,0]=4 719 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3nccs3 7d1ab2b9bc717eb6b33b0777773907a3 [0,0,0,1,0,1|1,1,0]=4 720 B18R3.28972 O=Cc1[nH]c(c2c1cccc2)c3nnco3 ecf30508d291218b7b613f5c13f5e334 [0,0,0,1,0,1|2,0,0]=4 721 B18R3.28972 O=Cc1cn(c2c1cccc2)c3ccco3 a7131906d19a68549bb630f729c905ff [0,0,0,1,0,1|0,0,0]=2 722 B18R3.28972 O=Cc1cn(c2c1cccc2)c3ccns3 5ddcc85e300def724e72d456918a36c6 [0,0,0,1,0,1|1,1,0]=4 723 B18R3.28972 O=Cc1cn(c2c1cccc2)c3ccsc3 1cad76879efc57944fe3080875eda4ca [0,0,0,1,0,1|2,0,0]=4 724 B18R3.28972 O=Cc1cn(c2c1cccc2)c3ncco3 01053842a5dbe3fae561a0598fa0af0e [0,0,0,1,0,1|1,0,0]=3 725 B18R3.28972 O=Cc1cn(c2c1cccc2)c3nnco3 e0aed4a09ed95bdab99cfd53ebfbc6ab [0,0,0,1,0,1|2,0,0]=4 726 B18R3.28972 O=Cc1cn(c2c1cccn2)c3ccco3 8fdc7e2499adc32eaef6cb858637ac30 [0,0,0,1,0,1|1,0,0]=3 727 B18R3.28972 O=Cc1cn(c2c1cccn2)c3cnco3 4d66d44dd3e903fdba7ca6414da25a26 [0,0,0,1,0,1|2,0,0]=4 728 B18R3.28972 O=Cc1cn(c2c1cccn2)c3ncco3 52cfa4491c73ccb428d73a2ed6d3c3e8 [0,0,0,1,0,1|2,0,0]=4 729 B18R3.28972 O=Cc1cn(c2c1ccnc2)c3ccco3 66ba2f7f48f66c1ab30560626ce1c1b4 [0,0,0,1,0,1|1,0,0]=3 730 B18R3.28972 O=Cc1cn(c2c1ccnc2)c3cnco3 7c9cd9dbcb64ddec0e3bb42cc4c50681 [0,0,0,1,0,1|2,0,0]=4 731 B18R3.28972 O=Cc1cn(c2c1ccnc2)c3ncco3 e8747f45a7fa98a89a9b495e4cac7e5b [0,0,0,1,0,1|2,0,0]=4 732 B18R3.28972 O=Cc1cn(c2c1cncc2)c3ccco3 3f8687ff2d3fd2fa779836266c71dc13 [0,0,0,1,0,1|1,0,0]=3 733 B18R3.28972 O=Cc1cn(c2c1cncc2)c3cnco3 0c692e51a2f38d29ceff778f3bb3eb93 [0,0,0,1,0,1|2,0,0]=4 734 B18R3.28972 O=Cc1cn(c2c1cncc2)c3ncco3 f02fa8a2f11b73ffef50ea2c6c76e4b3 [0,0,0,1,0,1|2,0,0]=4 735 B18R3.28972 O=Cc1cn(c2c1cncn2)c3ccco3 6671f37d6d7b7671de38e5c2dd708d49 [0,0,0,1,0,1|2,0,0]=4 736 B18R3.28972 O=Cc1cn(c2c1nccc2)c3ccco3 b81a2baf37bf600f9780720f039382a7 [0,0,0,1,0,1|1,0,0]=3 737 B18R3.28972 O=Cc1cn(c2c1nccc2)c3cnco3 16eaa97f5321bd081201fc4132cd578b [0,0,0,1,0,1|2,0,0]=4 738 B18R3.28972 O=Cc1cn(c2c1nccc2)c3ncco3 6014541b165926373e3a8bef35ea19d3 [0,0,0,1,0,1|2,0,0]=4 739 B18R3.28972 O=Cc1cn(c2c1nccn2)c3ccco3 d4970b02a2a2bce62e1685373b8b6ef4 [0,0,0,1,0,1|2,0,0]=4 740 B18R3.28972 O=Cc1nn(c2c1cccc2)c3ccco3 5729d97c0ac9847a42d3c34fb169d8ca [0,0,0,1,0,1|1,0,0]=3 741 B18R3.28972 O=Cc1nn(c2c1cccc2)c3ncco3 50825f50aff1eba74fb3c2947deac8da [0,0,0,1,0,1|2,0,0]=4 742 B18R3.28972 O=Cc1nn(c2c1cccn2)c3ccco3 9ef28674e5669c506de2cb2bb315993b [0,0,0,1,0,1|2,0,0]=4 743 B18R3.28972 OCc1cn(c2c1cccc2)c3ccco3 d877afa38e5221bcdee968dfc9fa2606 [0,0,0,1,0,1|0,0,2]=4 744 B18R3.2972 Brc1ccc(cc1)c2ccc3c(c2)CC=C3 66405afa49f3ad96675120c064ff1c76 [0,1,0,1,0,0|2,0,0]=4 745 B18R3.2972 Brc1ccc(cc1)c2ccc3cc[nH]c3c2 05635fafd9702fcd569815c0dd07218f [0,1,0,1,0,0|2,0,0]=4 746 B18R3.2972 Brc1ccc(cc1)c2ccc3ccoc3c2 d54dfdcfb08d7949c0ee96871fadb1af [0,1,0,1,0,0|1,0,0]=3 747 B18R3.2972 Brc1ccc(cc1)c2ccc3ccoc3n2 808825a8d57d170aff843e3bb56cea91 [0,1,0,1,0,0|2,0,0]=4 748 B18R3.2972 Brc1ccc(cc1)c2ccc3ccsc3c2 65217a707cd3d55b217fab9c1bacb49d [0,1,0,1,0,0|1,1,0]=4 749 B18R3.2972 Brc1ccc(cc1)c2ccc3cnoc3c2 66c81c3e4bb90d911dde92848cb92b9a [0,1,0,1,0,0|2,0,0]=4 750 B18R3.2972 Brc1ccc(cc1)c2ccc3ncoc3c2 952f2abebd33a04a0cf1a1a41a11067c [0,1,0,1,0,0|2,0,0]=4 751 B18R3.2972 Brc1ccc(cc1)c2cnc3cc[nH]c3c2 59e616b71832cc119bb5089fcc794bd0 [0,1,0,1,0,0|2,0,0]=4 752 B18R3.2972 Brc1ccc(cc1)c2cnc3ccoc3c2 7ed2d683d16c3e7db3485519b58b2730 [0,1,0,1,0,0|1,0,0]=3 753 B18R3.2972 Brc1ccc(cc1)c2cnc3ccsc3c2 721c97c159404487d694f45846779d97 [0,1,0,1,0,0|1,1,0]=4 754 B18R3.2972 Brc1ccc(cc1)c2cnc3ncoc3c2 c2e227011609ca144519f2d6191cf6db [0,1,0,1,0,0|2,0,0]=4 755 B18R3.2972 Brc1ccc(cn1)c2ccc3ccoc3c2 93be1252574cfe9e02e039b0c85be483 [0,1,0,1,0,0|2,0,0]=4 756 B18R3.2972 Brc1ccc(cn1)c2cnc3ccoc3c2 500488fdefba830f1067defcd3873078 [0,1,0,1,0,0|2,0,0]=4 757 B18R3.2972 Brc1ccc(nc1)c2ccc3ccoc3c2 d73a3363c61678cbc402bcafda0f5756 [0,1,0,1,0,0|2,0,0]=4 758 B18R3.2972 Brc1ccc(nc1)c2cnc3ccoc3c2 c1daf6a38506365a29095a010201170b [0,1,0,1,0,0|2,0,0]=4 759 B18R3.2972 Cc1ccc(cc1)c2ccc3c(c2)CC=C3 394c0e53b31aad5a22bb37ede550f567 [0,1,0,1,0,0|2,0,0]=4 760 B18R3.2972 Cc1ccc(cc1)c2ccc3cc[nH]c3c2 2748fa548a3257488f3b85669c5ed6ef [0,1,0,1,0,0|2,0,0]=4 761 B18R3.2972 Cc1ccc(cc1)c2ccc3ccoc3c2 85d611ec2083d8d8993f08c57053f82d [0,1,0,1,0,0|1,0,0]=3 762 B18R3.2972 Cc1ccc(cc1)c2ccc3ccoc3n2 34d7a622bcbfe8688d317e1b1c841561 [0,1,0,1,0,0|2,0,0]=4 763 B18R3.2972 Cc1ccc(cc1)c2ccc3ccsc3c2 dd4ec677991725dbabc94ea615a1093f [0,1,0,1,0,0|1,1,0]=4 764 B18R3.2972 Cc1ccc(cc1)c2ccc3cnoc3c2 943fb1b4e9894a839248332c23944c48 [0,1,0,1,0,0|2,0,0]=4 765 B18R3.2972 Cc1ccc(cc1)c2ccc3ncoc3c2 afcdae970d70f8f1120445cbca472abf [0,1,0,1,0,0|2,0,0]=4 766 B18R3.2972 Cc1ccc(cc1)c2cnc3cc[nH]c3c2 ac35a2f9fb3f6b7ef5c8cc887e27612d [0,1,0,1,0,0|2,0,0]=4 767 B18R3.2972 Cc1ccc(cc1)c2cnc3ccoc3c2 0aae5fa6115aa29e1fa1514cb1c4df6b [0,1,0,1,0,0|1,0,0]=3 768 B18R3.2972 Cc1ccc(cc1)c2cnc3ccsc3c2 d3c61cb1fe3b52b8832c72fa749117af [0,1,0,1,0,0|1,1,0]=4 769 B18R3.2972 Cc1ccc(cc1)c2cnc3ncoc3c2 08d66eeccaac04133aa27aec54456638 [0,1,0,1,0,0|2,0,0]=4 770 B18R3.2972 Cc1ccc(cn1)c2ccc3ccoc3c2 ae4c7ffcc66f07cf08faff15a4b8add2 [0,1,0,1,0,0|2,0,0]=4 771 B18R3.2972 Cc1ccc(cn1)c2cnc3ccoc3c2 6e8e7adbe398ba9bfcc97069f658c019 [0,1,0,1,0,0|2,0,0]=4 772 B18R3.2972 Cc1ccc(nc1)c2ccc3ccoc3c2 91b4d8cbe8395d6d3bf764e5513db266 [0,1,0,1,0,0|2,0,0]=4 773 B18R3.2972 Cc1ccc(nc1)c2cnc3ccoc3c2 2c6cc70c6763ae52b563eefea0106722 [0,1,0,1,0,0|2,0,0]=4 774 B18R3.2972 Clc1ccc(cc1)c2ccc3c(c2)CC=C3 cfbb110215f98b906c629bbf07b4f228 [0,1,0,1,0,0|2,0,0]=4 775 B18R3.2972 Clc1ccc(cc1)c2ccc3cc[nH]c3c2 f02cac10650a203297b19c6381f1e6e3 [0,1,0,1,0,0|2,0,0]=4 776 B18R3.2972 Clc1ccc(cc1)c2ccc3ccoc3c2 7cc09c41fd8779f322595135860b6d83 [0,1,0,1,0,0|1,0,0]=3 777 B18R3.2972 Clc1ccc(cc1)c2ccc3ccoc3n2 c71deea89709a4eaf727542c0965492f [0,1,0,1,0,0|2,0,0]=4 778 B18R3.2972 Clc1ccc(cc1)c2ccc3ccsc3c2 5187300cc350f4faa803fdfaabf5aa92 [0,1,0,1,0,0|1,1,0]=4 779 B18R3.2972 Clc1ccc(cc1)c2ccc3cnoc3c2 f23096f6abb4758698d8758cd7aafc5d [0,1,0,1,0,0|2,0,0]=4 780 B18R3.2972 Clc1ccc(cc1)c2ccc3ncoc3c2 89fa642d1c3e56eed4f3d74d231e3e77 [0,1,0,1,0,0|2,0,0]=4 781 B18R3.2972 Clc1ccc(cc1)c2cnc3cc[nH]c3c2 c1f69309e24e4fc63508127292175399 [0,1,0,1,0,0|2,0,0]=4 782 B18R3.2972 Clc1ccc(cc1)c2cnc3ccoc3c2 77c91b35c74cdf9e0c6ed889e16f3f21 [0,1,0,1,0,0|1,0,0]=3 783 B18R3.2972 Clc1ccc(cc1)c2cnc3ccsc3c2 fd17f143902c4497f77ff5536b439390 [0,1,0,1,0,0|1,1,0]=4 784 B18R3.2972 Clc1ccc(cc1)c2cnc3ncoc3c2 027f458c81e10aa2e6bf4393c86754a3 [0,1,0,1,0,0|2,0,0]=4 785 B18R3.2972 Clc1ccc(cn1)c2ccc3ccoc3c2 de6898b45a72c61ee3a17eb5a4d95892 [0,1,0,1,0,0|2,0,0]=4 786 B18R3.2972 Clc1ccc(cn1)c2cnc3ccoc3c2 4cdf03551590671a061ba1ba3e384d61 [0,1,0,1,0,0|2,0,0]=4 787 B18R3.2972 Clc1ccc(nc1)c2ccc3ccoc3c2 536c1c6aeb97583eee54443933e90207 [0,1,0,1,0,0|2,0,0]=4 788 B18R3.2972 Clc1ccc(nc1)c2cnc3ccoc3c2 71bd0062a71d11f30fb33e3a443d1a5e [0,1,0,1,0,0|2,0,0]=4 789 B18R3.2972 Fc1ccc(cc1)c2ccc3c(c2)CC=C3 17828210941613b3ec0cffba3c1367a4 [0,1,0,1,0,0|2,0,0]=4 790 B18R3.2972 Fc1ccc(cc1)c2ccc3cc[nH]c3c2 f8772124ac62dbed1f3c5f1293c7deb9 [0,1,0,1,0,0|2,0,0]=4 791 B18R3.2972 Fc1ccc(cc1)c2ccc3ccoc3c2 1d11056a954978b66b035ac5cfd559cc [0,1,0,1,0,0|1,0,0]=3 792 B18R3.2972 Fc1ccc(cc1)c2ccc3ccoc3n2 ad536746c4e9f1a2db58a94806fc46e3 [0,1,0,1,0,0|2,0,0]=4 793 B18R3.2972 Fc1ccc(cc1)c2ccc3ccsc3c2 aa534a58161b016de18f9f4e4096dc92 [0,1,0,1,0,0|1,1,0]=4 794 B18R3.2972 Fc1ccc(cc1)c2ccc3cnoc3c2 6987e0b9885524deca39fcb2d78d1b55 [0,1,0,1,0,0|2,0,0]=4 795 B18R3.2972 Fc1ccc(cc1)c2ccc3ncoc3c2 694476d129b8b0a98512d4e1d3d824d2 [0,1,0,1,0,0|2,0,0]=4 796 B18R3.2972 Fc1ccc(cc1)c2cnc3cc[nH]c3c2 89d52abe65fd4df440114c611ba0c285 [0,1,0,1,0,0|2,0,0]=4 797 B18R3.2972 Fc1ccc(cc1)c2cnc3ccoc3c2 fc3d82254f5a67a178d6cd69c6e16d46 [0,1,0,1,0,0|1,0,0]=3 798 B18R3.2972 Fc1ccc(cc1)c2cnc3ccsc3c2 aed5ef8e2fe28b885a7b6807272f4ebb [0,1,0,1,0,0|1,1,0]=4 799 B18R3.2972 Fc1ccc(cc1)c2cnc3ncoc3c2 940e01868f4f6cf42fc5ddeff7e03914 [0,1,0,1,0,0|2,0,0]=4 800 B18R3.2972 Fc1ccc(cn1)c2ccc3ccoc3c2 083c97bf03a210932480782351927533 [0,1,0,1,0,0|2,0,0]=4 801 B18R3.2972 Fc1ccc(cn1)c2cnc3ccoc3c2 ca3194ba293c3e86625eb700073c06b9 [0,1,0,1,0,0|2,0,0]=4 802 B18R3.2972 Fc1ccc(nc1)c2ccc3ccoc3c2 7dfa83060a45fabc58a0046819e9c4e6 [0,1,0,1,0,0|2,0,0]=4 803 B18R3.2972 Fc1ccc(nc1)c2cnc3ccoc3c2 72a4bdbc0fc6099fe628258f71758c9b [0,1,0,1,0,0|2,0,0]=4 804 B18R3.2972 Ic1ccc(cc1)c2ccc3c(c2)CC=C3 228a9e2f8946f720cc77c65194a06792 [0,1,0,1,0,0|2,0,0]=4 805 B18R3.2972 Ic1ccc(cc1)c2ccc3cc[nH]c3c2 24f4e09a38f7b33e5b9e70fcc9ae27db [0,1,0,1,0,0|2,0,0]=4 806 B18R3.2972 Ic1ccc(cc1)c2ccc3ccoc3c2 ea0c728b6638d03bed95f85fcf4ef57f [0,1,0,1,0,0|1,0,0]=3 807 B18R3.2972 Ic1ccc(cc1)c2ccc3ccoc3n2 050bc349fe3d6f1fd71ef2846e82d6b0 [0,1,0,1,0,0|2,0,0]=4 808 B18R3.2972 Ic1ccc(cc1)c2ccc3ccsc3c2 d25e33731549cec0817d097520d49696 [0,1,0,1,0,0|1,1,0]=4 809 B18R3.2972 Ic1ccc(cc1)c2ccc3cnoc3c2 c43c34e1c9051266a6c6bb9789b7670d [0,1,0,1,0,0|2,0,0]=4 810 B18R3.2972 Ic1ccc(cc1)c2ccc3ncoc3c2 1e160a44f2fa92a74ad89ba8c241bb9b [0,1,0,1,0,0|2,0,0]=4 811 B18R3.2972 Ic1ccc(cc1)c2cnc3cc[nH]c3c2 5c19f41ddad42185d4a7a12addb141ee [0,1,0,1,0,0|2,0,0]=4 812 B18R3.2972 Ic1ccc(cc1)c2cnc3ccoc3c2 8b1d2ca68191aba3e4a67baef520984d [0,1,0,1,0,0|1,0,0]=3 813 B18R3.2972 Ic1ccc(cc1)c2cnc3ccsc3c2 4f7b9aee1b6df44755ce405ed3914a60 [0,1,0,1,0,0|1,1,0]=4 814 B18R3.2972 Ic1ccc(cc1)c2cnc3ncoc3c2 e88828ac3e81858f09d938fe7f08127d [0,1,0,1,0,0|2,0,0]=4 815 B18R3.2972 Nc1ccc(cc1)c2ccc3cc[nH]c3c2 dd0f1dce29f49bcb5105fb7d45c9e18f [0,1,0,1,0,0|2,0,0]=4 816 B18R3.2972 Nc1ccc(cc1)c2ccc3ccoc3c2 cf6cdc75cb72e1657c0dbfc4cf1fffef [0,1,0,1,0,0|1,0,0]=3 817 B18R3.2972 Nc1ccc(cc1)c2ccc3ccsc3c2 21e061e966a9243e9212736e12ba414f [0,1,0,1,0,0|1,1,0]=4 818 B18R3.2972 Nc1ccc(cc1)c2ccc3ncoc3c2 fce0dc42de87c708c0c303c0b2d8152c [0,1,0,1,0,0|2,0,0]=4 819 B18R3.2972 Nc1ccc(cc1)c2cnc3cc[nH]c3c2 214295be84e0c72c4f9c67b58a4edaed [0,1,0,1,0,0|2,0,0]=4 820 B18R3.2972 Nc1ccc(cc1)c2cnc3ccoc3c2 331684133a1e7d9cbe26aa53cf612c64 [0,1,0,1,0,0|1,0,0]=3 821 B18R3.2972 Nc1ccc(cc1)c2cnc3ccsc3c2 a34ea4a95235a7d41a5084b30d775d64 [0,1,0,1,0,0|1,1,0]=4 822 B18R3.2972 Nc1ccc(cn1)c2ccc3ccoc3c2 ad1c1ed2a1b7c90e708a6ed89372c82d [0,1,0,1,0,0|2,0,0]=4 823 B18R3.2972 Nc1ccc(cn1)c2cnc3ccoc3c2 834e825117dc34a2ee10982204181f22 [0,1,0,1,0,0|2,0,0]=4 824 B18R3.2972 Nc1ccc(nc1)c2ccc3ccoc3c2 c58b240d15e2623bf70f52e4dcc812bc [0,1,0,1,0,0|2,0,0]=4 825 B18R3.2972 Nc1ccc(nc1)c2cnc3ccoc3c2 25ada2567230b83a63d51c5d59ef33c9 [0,1,0,1,0,0|2,0,0]=4 826 B18R3.2972 O=c1ccc(c[nH]1)c2ccc3ccoc3c2 ea334f0aaa61282fb9e9ef4505b872c0 [0,1,0,1,0,0|2,0,0]=4 827 B18R3.2972 O=c1ccc(co1)c2ccc3ccoc3c2 a8aa6f058e81b4f36199598351e14824 [0,1,0,1,0,0|2,0,0]=4 828 B18R3.2972 O=c1ccc(co1)c2cnc3ccoc3c2 9d9772ce0fef6a18d7c880cd2ded6e5f [0,1,0,1,0,0|2,0,0]=4 829 B18R3.2972 Oc1ccc(cc1)c2ccc3c(c2)CC=C3 69f54628aaea9a405b224acd50ae843a [0,1,0,1,0,0|2,0,0]=4 830 B18R3.2972 Oc1ccc(cc1)c2ccc3cc[nH]c3c2 e4d656b2ac38733c8f0a9fcb32402f6b [0,1,0,1,0,0|2,0,0]=4 831 B18R3.2972 Oc1ccc(cc1)c2ccc3ccoc3c2 ead41a723eb473b47074e645ed1a69e4 [0,1,0,1,0,0|1,0,0]=3 832 B18R3.2972 Oc1ccc(cc1)c2ccc3ccoc3n2 08f06f85ee2a65c58f879581c06ac414 [0,1,0,1,0,0|2,0,0]=4 833 B18R3.2972 Oc1ccc(cc1)c2ccc3ccsc3c2 715fb7aae48d0dc4190f497d5ff9ce05 [0,1,0,1,0,0|1,1,0]=4 834 B18R3.2972 Oc1ccc(cc1)c2ccc3cnoc3c2 c1dfa6ac6762542cae04f923c8170763 [0,1,0,1,0,0|2,0,0]=4 835 B18R3.2972 Oc1ccc(cc1)c2ccc3ncoc3c2 f25876562a593e377313b46b1c0f0660 [0,1,0,1,0,0|2,0,0]=4 836 B18R3.2972 Oc1ccc(cc1)c2cnc3cc[nH]c3c2 33a379a52f3a62fad7767d7cf476c221 [0,1,0,1,0,0|2,0,0]=4 837 B18R3.2972 Oc1ccc(cc1)c2cnc3ccoc3c2 1baeb99449c744fc9b2f7ac8de1f185c [0,1,0,1,0,0|1,0,0]=3 838 B18R3.2972 Oc1ccc(cc1)c2cnc3ccsc3c2 8a25aff2a4ea96fa569ecff370bf43e0 [0,1,0,1,0,0|1,1,0]=4 839 B18R3.2972 Oc1ccc(cc1)c2cnc3ncoc3c2 98682481624757daa9bda323a4705334 [0,1,0,1,0,0|2,0,0]=4 840 B18R3.2972 Oc1ccc(cn1)c2cnc3ccoc3c2 aa22fefedb18564bad5f2bcbf649cb75 [0,1,0,1,0,0|2,0,0]=4 841 B18R3.2972 Oc1ccc(nc1)c2ccc3ccoc3c2 8ff4c6d59c08412127bd2558026ea518 [0,1,0,1,0,0|2,0,0]=4 842 B18R3.2972 Oc1ccc(nc1)c2cnc3ccoc3c2 9646dc7fce9683f29b5eb31ee7bc2783 [0,1,0,1,0,0|2,0,0]=4 843 B18R3.2972 Sc1ccc(cc1)c2ccc3c(c2)CC=C3 8dac20f737d1d7d79897e20ccd0bb127 [0,1,0,1,0,0|2,0,0]=4 844 B18R3.2972 Sc1ccc(cc1)c2ccc3cc[nH]c3c2 40442242eb3ba197752b00472804cbd1 [0,1,0,1,0,0|2,0,0]=4 845 B18R3.2972 Sc1ccc(cc1)c2ccc3ccoc3c2 113bc11487c827759e137c1ad289eced [0,1,0,1,0,0|1,0,0]=3 846 B18R3.2972 Sc1ccc(cc1)c2ccc3ccoc3n2 bb8caab170d9e9d5fd36ec0b011d941b [0,1,0,1,0,0|2,0,0]=4 847 B18R3.2972 Sc1ccc(cc1)c2ccc3ccsc3c2 2f8dc42af3ebb1da5aeb208cbaa85a04 [0,1,0,1,0,0|1,1,0]=4 848 B18R3.2972 Sc1ccc(cc1)c2ccc3cnoc3c2 dfbe7dc3da551fd813df8b6df537be2e [0,1,0,1,0,0|2,0,0]=4 849 B18R3.2972 Sc1ccc(cc1)c2ccc3ncoc3c2 57b52e52952318bbf9b114c4bf67fb9b [0,1,0,1,0,0|2,0,0]=4 850 B18R3.2972 Sc1ccc(cc1)c2cnc3cc[nH]c3c2 56a4889b31999c10acb4d4703aa9cec8 [0,1,0,1,0,0|2,0,0]=4 851 B18R3.2972 Sc1ccc(cc1)c2cnc3ccoc3c2 7d5ce639bbaf4893dffd51cce87c8474 [0,1,0,1,0,0|1,0,0]=3 852 B18R3.2972 Sc1ccc(cc1)c2cnc3ccsc3c2 5c844c684de875eb4dfefc91f92790a4 [0,1,0,1,0,0|1,1,0]=4 853 B18R3.2972 Sc1ccc(cc1)c2cnc3ncoc3c2 797bf4d4d00ddb48b1f9440c6a919fb5 [0,1,0,1,0,0|2,0,0]=4 854 B18R3.2972 Sc1ccc(cn1)c2ccc3ccoc3c2 b4ccad0ea0d4d3f11152674f40ebd9ad [0,1,0,1,0,0|2,0,0]=4 855 B18R3.2972 Sc1ccc(cn1)c2cnc3ccoc3c2 69b95572b8118ec118fda2ee7f83ab2b [0,1,0,1,0,0|2,0,0]=4 856 B18R3.2972 Sc1ccc(nc1)c2ccc3ccoc3c2 7ebf343ea766e67bd141a61ea5794883 [0,1,0,1,0,0|2,0,0]=4 857 B18R3.2972 Sc1ccc(nc1)c2cnc3ccoc3c2 9b4f596c1a3a46c85566e1048075a8ce [0,1,0,1,0,0|2,0,0]=4 858 B18R3.2972 [O-][n+]1ccc(cc1)c2ccc3ccoc3c2 da655ac76f86b510b22473cb8feb3726 [0,1,0,1,0,0|2,0,0]=4 859 B18R3.2972 [O-][n+]1ccc(cc1)c2cnc3ccoc3c2 378ef5ee391bc22c7c77d6b80a5af402 [0,1,0,1,0,0|2,0,0]=4 860 B18R3.11 c1coc(c1)Nc2ccnc3c2cccc3 8851b2205b88931fba518db7ade79783 [0,1,0,1,0,0|2,0,0]=4 861 B18R3.11 c1coc(c1)Nc2nccc3c2cccc3 6bd35d65f5d0ad3b9cdc3b918b792e67 [0,1,0,1,0,0|2,0,0]=4 862 B18R3.2107 c1ccc(cc1)c2[nH]ncc2c3ccco3 ed411fb7a6c78fa97f590d61aa57bf2c [0,1,0,1,0,0|2,0,0]=4 863 B18R3.2107 c1ccc(cc1)c2c[nH]nc2c3cccs3 0747a87f588ab893e7ed4679a02e094c [0,1,0,1,0,0|1,1,0]=4 864 B18R3.2107 c1ccc(cc1)c2ccsc2c3ccc[nH]3 e5890811fcd1bb4fcf5f17dab291611b [0,1,0,1,0,0|1,1,0]=4 865 B18R3.2107 c1ccc(cc1)c2ccsc2c3ccco3 759730af32915a8654077661d4a7183e [0,1,0,1,0,0|0,1,0]=3 866 B18R3.2107 c1ccc(cc1)c2ccsc2c3cccs3 c4c52351b737074c9504cffc8a0b8f6f [0,1,0,1,0,0|0,2,0]=4 867 B18R3.2107 c1ccc(cc1)c2cn[nH]c2c3ccco3 1f5abe53dea00e2b628d6f62968a38e7 [0,1,0,1,0,0|1,0,0]=3 868 B18R3.2107 c1ccc(cc1)c2cn[nH]c2c3ccno3 81cb97b4cb3a6817d41f22d74c23779c [0,1,0,1,0,0|2,0,0]=4 869 B18R3.2107 c1ccc(cc1)c2cn[nH]c2c3ncco3 d29ed51d58200db1c4702acad1759aa8 [0,1,0,1,0,0|2,0,0]=4 870 B18R3.2107 c1ccc(cc1)c2conc2c3ccc[nH]3 9979773a3f6f5b1f6ebfa7edacd52b1f [0,1,0,1,0,0|1,0,1]=4 871 B18R3.2107 c1ccc(cc1)c2conc2c3ccco3 2e47ce9ce22c7ded6b95275866ee7fe5 [0,1,0,1,0,0|0,0,1]=3 872 B18R3.2107 c1ccc(cc1)c2conc2c3cccs3 ebe0849033a080eea09d351253c0662c [0,1,0,1,0,0|0,1,1]=4 873 B18R3.2107 c1ccc(cc1)c2cscc2c3ccc[nH]3 029ba0c53a31edc2563ce4e229b00fee [0,1,0,1,0,0|1,1,0]=4 874 B18R3.2107 c1ccc(cc1)c2cscc2c3ccco3 a0a7928bb300d8410484cf78640852a0 [0,1,0,1,0,0|0,1,0]=3 875 B18R3.2107 c1ccc(cc1)c2cscc2c3cccs3 8d381f4d8054137b69f9cac5479c2c6f [0,1,0,1,0,0|0,2,0]=4 876 B18R3.2107 c1ccc(cc1)c2nc[nH]c2c3ccc[nH]3 591b2dc66ef473794a093d2930da3238 [0,1,0,1,0,0|2,0,0]=4 877 B18R3.2107 c1ccc(cc1)c2nc[nH]c2c3ccco3 722ed16c553637051ac3ec85f3bea658 [0,1,0,1,0,0|1,0,0]=3 878 B18R3.2107 c1ccc(cc1)c2nc[nH]c2c3cccs3 a11ddd773628b21fa5b0e54e837af2fd [0,1,0,1,0,0|1,1,0]=4 879 B18R3.2107 c1ccc(cc1)c2nccn2c3ccco3 667ae3185a187a8a237d95f3f2ea414d [0,1,0,1,0,0|2,0,0]=4 880 B18R3.2107 c1ccc(cc1)c2ncoc2c3ccc[nH]3 9f67370df2957daeb955099ec0ccdb7e [0,1,0,1,0,0|1,0,1]=4 881 B18R3.2107 c1ccc(cc1)c2ncoc2c3ccco3 31bd07de1af8f6c92e823ffdd8b0fcd5 [0,1,0,1,0,0|0,0,1]=3 882 B18R3.2107 c1ccc(cc1)c2ncoc2c3cccs3 443a8677792e45f24eb6d6ade08d9d1a [0,1,0,1,0,0|0,1,1]=4 883 B18R3.2107 c1ccc(cc1)c2nnsc2c3ccco3 cc500f8e6c7ca9b256eb4cb794c5efb2 [0,1,0,1,0,0|1,1,0]=4 884 B18R3.2107 c1ccc(cc1)c2nocc2c3ccco3 c7d5c204ea4ae799996cb1b9dae0c7a5 [0,1,0,1,0,0|1,0,1]=4 885 B18R3.2107 c1ccc(cc1)c2nsnc2c3ccco3 719ff4c6f7d605b358f783540c9096ee [0,1,0,1,0,0|1,1,0]=4 886 B18R3.2107 c1ccc(cc1)c2ocnc2c3ccc[nH]3 582c0c506934cda6948efa9ec819dd9e [0,1,0,1,0,0|2,0,0]=4 887 B18R3.2107 c1ccc(cc1)c2ocnc2c3ccco3 5b7f3e428d433af9aa229a07402b0e4b [0,1,0,1,0,0|1,0,0]=3 888 B18R3.2107 c1ccc(cc1)c2ocnc2c3cccs3 9edd207a809a54720163b20cb0e093e9 [0,1,0,1,0,0|1,1,0]=4 889 B18R3.2107 c1ccc(cc1)n2ccnc2c3ccco3 f4c92240f476b0c84fac66523209ad69 [0,1,0,1,0,0|2,0,0]=4 890 B18R3.2107 c1ccc(cc1)n2nccc2c3ccco3 3db2c89f50e0eeb40bd7ab64b59ec9f3 [0,1,0,1,0,0|2,0,0]=4 891 B18R3.2107 c1ccc(cc1)n2ncnc2c3ccco3 2e3a5ce79d4ebe2f913bc5417508e843 [0,1,0,1,0,0|2,0,0]=4 892 B18R3.6550 Cc1cc(cc2c1cc[nH]2)c3ccccc3 d28997d1b11cf0d1fc5f43854bb235b8 [0,1,0,1,0,0|2,0,0]=4 893 B18R3.6550 Cc1nc(cc2c1cc[nH]2)c3ccccc3 79025eda60fae20aae313587d07f89f5 [0,1,0,1,0,0|2,0,0]=4 894 B18R3.6550 Fc1cc(cc2c1cc[nH]2)c3ccccc3 495e8b366625717897bb7d16af59097b [0,1,0,1,0,0|2,0,0]=4 895 B18R3.6550 Fc1cc(cc2c1ccs2)c3ccccc3 a67510df69d1d6465b7ac5e5d69c14a3 [0,1,0,1,0,0|1,1,0]=4 896 B18R3.6550 Fc1cc(cc2c1nco2)c3ccccc3 cda244dc997a19b80a7e030667be031b [0,1,0,1,0,0|2,0,0]=4 897 B18R3.6550 Nc1cc(cc2c1cc[nH]2)c3ccccc3 2af11a0898b207c6a29e69bff623fd93 [0,1,0,1,0,0|2,0,0]=4 898 B18R3.6550 O=c1[nH]c(nc2c1cc[nH]2)c3ccccc3 d13a80094c54b3c731bbb7e2dd0c730f [0,1,0,1,0,0|2,0,0]=4 899 B18R3.6550 O=c1[nH]c(nc2c1ccs2)c3ccccc3 e36aad4bf6710c183b93e4ad44ada177 [0,1,0,1,0,0|1,1,0]=4 900 B18R3.618712 O=C1CC(c2c1cccc2)Oc3ccco3 464a19098f4d2e3a998435da30d8911d [0,1,0,1,0,0|1,0,1]=4 901 B18R3.618712 O=C1OC(c2c1cccc2)Oc3ccco3 f0cf9ad60428e7c03d483b8cdcb51167 [0,1,0,1,0,0|1,0,1]=4 902 B18R3.28939 N#Cc1c([nH]c2c1cccc2)c3ccco3 369afd78e67e18e23cabac1fabb98b06 [0,1,0,1,0,0|1,0,1]=4 903 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3cc[nH]c3 33ec9c0bdf96719a2b873c28484cb3c6 [0,1,0,1,0,0|2,0,0]=4 904 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ccc[nH]3 f143143ef9bb18178878c668cb9244a4 [0,1,0,1,0,0|1,0,0]=3 905 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ccco3 f46878be503ce2205b8ab8e9f8171788 [0,1,0,1,0,0|0,0,0]=2 906 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3cccs3 c3031d9ef2641bb440069e549f31046f [0,1,0,1,0,0|0,1,0]=3 907 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ccn[nH]3 836fcd804dd0ce0cab0ee20bb4649897 [0,1,0,1,0,0|2,0,0]=4 908 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ccns3 2849d8e51483f39f27a6afe02021928c [0,1,0,1,0,0|1,1,0]=4 909 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ccoc3 7ca3b6fbb537ff38725d75b4685b91cd [0,1,0,1,0,0|2,0,0]=4 910 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ccsc3 fe80c9cf6db1be30541e5164c379698b [0,1,0,1,0,0|2,0,0]=4 911 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3cnco3 4b23d26996a6f39e83055c456be88053 [0,1,0,1,0,0|1,0,0]=3 912 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3cncs3 3235fb56b84ca244445987cf0f63d59d [0,1,0,1,0,0|1,1,0]=4 913 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3cocn3 f99f36a378641575f5a0db650f2efce5 [0,1,0,1,0,0|2,0,0]=4 914 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3cscn3 705bacc7ba11b92f546b15962b1a96af [0,1,0,1,0,0|2,0,0]=4 915 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3ncc[nH]3 d4d321da9b99bf4a20eb0d426092fe05 [0,1,0,1,0,0|2,0,0]=4 916 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3nccs3 f6f579cb73b163cf723fa95270c85684 [0,1,0,1,0,0|1,1,0]=4 917 B18R3.28939 O=Cc1c([nH]c2c1cccc2)c3nnco3 1b6cb8377947b60b32a87e342469f121 [0,1,0,1,0,0|2,0,0]=4 918 B18R3.28939 O=Cc1c([nH]c2c1ccnc2)c3ccc[nH]3 ceb21b8d91e8c6cfba6bd4ed7846434e [0,1,0,1,0,0|2,0,0]=4 919 B18R3.28939 O=Cc1c([nH]c2c1ccnc2)c3ccco3 bf23698a248722c1256376846940ec5e [0,1,0,1,0,0|1,0,0]=3 920 B18R3.28939 O=Cc1c([nH]c2c1ccnc2)c3cccs3 5be1519cd6e52c001a72ac65ed598308 [0,1,0,1,0,0|1,1,0]=4 921 B18R3.28939 O=Cc1c([nH]c2c1ccnc2)c3cnco3 1704cae5e5b5013737b999cff4403bcd [0,1,0,1,0,0|2,0,0]=4 922 B18R3.28939 O=Cc1c(nc2n1cccc2)c3ccc[nH]3 9b3182b6826fa38f207e72215ba3ebb1 [0,1,0,1,0,0|2,0,0]=4 923 B18R3.28939 O=Cc1c(nc2n1cccc2)c3ccco3 e30760e13df15b7120eb10a3838853e8 [0,1,0,1,0,0|1,0,0]=3 924 B18R3.28939 O=Cc1c(nc2n1cccc2)c3cccs3 a313cefd8c04bc547250dca3c9c668ea [0,1,0,1,0,0|1,1,0]=4 925 B18R3.28939 O=Cc1c(nc2n1cccc2)c3cnco3 811638813067c557935dd7f981176b4d [0,1,0,1,0,0|2,0,0]=4 926 B18R3.28939 O=Cc1c(oc2c1cccc2)c3cc[nH]c3 5592bbc09514b495a80905dce31dba5e [0,1,0,1,0,0|2,0,0]=4 927 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ccc[nH]3 cc31896cb990d73d5da1565c5375c1b4 [0,1,0,1,0,0|1,0,0]=3 928 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ccco3 e7ff304405e522623acbb83089ff3464 [0,1,0,1,0,0|0,0,0]=2 929 B18R3.28939 O=Cc1c(oc2c1cccc2)c3cccs3 633f78f7ec8d63222485ddbe16e0398c [0,1,0,1,0,0|0,1,0]=3 930 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ccn[nH]3 958c0a868438893dab9a6d6aed25147e [0,1,0,1,0,0|2,0,0]=4 931 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ccns3 6d24c758f9657054472cd0e440a5cd0c [0,1,0,1,0,0|1,1,0]=4 932 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ccoc3 d3c83c76a1fa6389cfc09239665a17b6 [0,1,0,1,0,0|2,0,0]=4 933 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ccsc3 cca65bba4ccc55a3e4fe6d329db57edb [0,1,0,1,0,0|2,0,0]=4 934 B18R3.28939 O=Cc1c(oc2c1cccc2)c3cnco3 67adc0a866ea276516fb3437dfb158c7 [0,1,0,1,0,0|1,0,0]=3 935 B18R3.28939 O=Cc1c(oc2c1cccc2)c3cncs3 eabbd8601d3d68d0d083c3483c08aebe [0,1,0,1,0,0|1,1,0]=4 936 B18R3.28939 O=Cc1c(oc2c1cccc2)c3cocn3 4738f882853822e617a67bc76cbc8639 [0,1,0,1,0,0|2,0,0]=4 937 B18R3.28939 O=Cc1c(oc2c1cccc2)c3cscn3 acf2c11ad11a71eb5da1cb00e5e376ce [0,1,0,1,0,0|2,0,0]=4 938 B18R3.28939 O=Cc1c(oc2c1cccc2)c3ncc[nH]3 7b6b9038ece2c9aff02ab8514cf768f9 [0,1,0,1,0,0|2,0,0]=4 939 B18R3.28939 O=Cc1c(oc2c1cccc2)c3nccs3 6d2734c240f0e2c630e039403d19d02c [0,1,0,1,0,0|1,1,0]=4 940 B18R3.28939 O=Cc1c(oc2c1cccc2)c3nnco3 ebcee541549be4cfb522e84a7f217130 [0,1,0,1,0,0|2,0,0]=4 941 B18R3.28939 O=Cc1c(sc2c1cccc2)c3cc[nH]c3 d4067c34797bde2a84c23cee90d07bb7 [0,1,0,1,0,0|2,0,0]=4 942 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ccc[nH]3 3f1958eb13b2ab8b46aa38adcbf3e1a0 [0,1,0,1,0,0|1,0,0]=3 943 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ccco3 25629a0f55780532b8ca70390c8bc090 [0,1,0,1,0,0|0,0,0]=2 944 B18R3.28939 O=Cc1c(sc2c1cccc2)c3cccs3 d3dd19afc1e44e379afacab4ed92b81b [0,1,0,1,0,0|0,1,0]=3 945 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ccn[nH]3 0109200331376dffd2f98c06349e5e92 [0,1,0,1,0,0|2,0,0]=4 946 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ccns3 529e0b4de07c272f8e5cd6c87ebd89ae [0,1,0,1,0,0|1,1,0]=4 947 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ccoc3 ed866adc5801e421de52099a5c5dd79a [0,1,0,1,0,0|2,0,0]=4 948 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ccsc3 a61584f458fe3dbe632706a93313e59b [0,1,0,1,0,0|2,0,0]=4 949 B18R3.28939 O=Cc1c(sc2c1cccc2)c3cncs3 b25748ff93640b7b70e87c9c42b20d1e [0,1,0,1,0,0|1,1,0]=4 950 B18R3.28939 O=Cc1c(sc2c1cccc2)c3cocn3 66c3478e26563a8c29d669143cde92ea [0,1,0,1,0,0|2,0,0]=4 951 B18R3.28939 O=Cc1c(sc2c1cccc2)c3cscn3 477e2bc6a5101e0a204e7e7a2acff4d3 [0,1,0,1,0,0|2,0,0]=4 952 B18R3.28939 O=Cc1c(sc2c1cccc2)c3ncc[nH]3 dde2bdc9c0fb221169bcd31ce681ea7b [0,1,0,1,0,0|2,0,0]=4 953 B18R3.28939 O=Cc1c(sc2c1cccc2)c3nccs3 349f9213373c5bb4e3439fca32f87c28 [0,1,0,1,0,0|1,1,0]=4 954 B18R3.28939 O=Cc1c(sc2c1cccc2)c3nnco3 4ed0b67842a099618c2dacdbd0f4732d [0,1,0,1,0,0|2,0,0]=4 955 B18R3.28939 OCc1c([nH]c2c1cccc2)c3ccco3 44592026ddba845a34fbf7dce8aa71f9 [0,1,0,1,0,0|0,0,2]=4 956 B18R3.151 Cc1cc2ccc(cc2[nH]1)c3ccccc3 d85abd126875522a8308a91db4bc1752 [0,1,0,1,0,0|2,0,0]=4 957 B18R3.151 Cc1cc2ccc(cc2s1)c3ccccc3 82d291f0dd20e2f5aa7e8536bd66c685 [0,1,0,1,0,0|1,1,0]=4 958 B18R3.151 Cc1cc2ncc(cc2[nH]1)c3ccccc3 f4321d48faef69dfc1caf60284c1d3a2 [0,1,0,1,0,0|2,0,0]=4 959 B18R3.151 Cc1nc2ccc(cc2o1)c3ccccc3 0d20ab7bfce19c628937fce6da93349a [0,1,0,1,0,0|2,0,0]=4 960 B18R3.151 Cc1nc2ncc(cc2o1)c3ccccc3 992dac52ab40c811c0db713cd6e6a246 [0,1,0,1,0,0|2,0,0]=4 961 B18R3.151 Nc1cc2ccc(cc2s1)c3ccccc3 b5f822252a17e4cec56d48a4f77414e3 [0,1,0,1,0,0|1,1,0]=4 962 B18R3.151 Nc1cc2ncc(cc2s1)c3ccccc3 5c129dd5d75d409f6a87632e82ee7430 [0,1,0,1,0,0|1,1,0]=4 963 B18R3.151 Nc1nc2ccc(cc2o1)c3ccccc3 cb77de03ece1b9d8a1bced60168d9888 [0,1,0,1,0,0|2,0,0]=4 964 B18R3.151 O=C1Cc2ccc(cc2O1)c3ccccc3 e1101797a7d36b409654d1fcbd63ea9f [0,1,0,1,0,0|1,0,1]=4 965 B18R3.151 O=c1[nH]c2ccc(cc2o1)c3ccccc3 8ba708a2bc8d60a465f61a08286e001d [0,1,0,1,0,0|2,0,0]=4 966 B18R3.151 O=c1[nH]c2ncc(cc2o1)c3ccccc3 d49fb2e5c09007323aa8317753f8adb4 [0,1,0,1,0,0|2,0,0]=4 967 B18R3.151 S=c1[nH]c2ccc(cc2o1)c3ccccc3 2d1a2493d4352ae5833732c023f2c238 [0,1,0,1,0,0|2,0,0]=4 968 B18R3.4180 CC1=CCc2c1ccc(c2)c3ccccc3 1d6800d8b1b52934ec1bfea693fa967c [0,1,0,1,0,0|2,0,0]=4 969 B18R3.4180 Cc1c[nH]c2c1ccc(c2)c3ccccc3 cf48dc7baa4dd04526fb658388d01e7d [0,1,0,1,0,0|2,0,0]=4 970 B18R3.4180 Cc1c[nH]c2c1ncc(c2)c3ccccc3 4f6ee9c9d584ab62eba121c3d08aa0bd [0,1,0,1,0,0|2,0,0]=4 971 B18R3.4180 Cc1coc2c1ccc(c2)c3ccccc3 6471d2c0f2a9922875572a155f5f1d4c [0,1,0,1,0,0|1,0,0]=3 972 B18R3.4180 Cc1coc2c1ccc(c2)c3ccccn3 071c5fa4253f6cbf6daf33dd5dc2fa92 [0,1,0,1,0,0|2,0,0]=4 973 B18R3.4180 Cc1coc2c1ccc(c2)c3cccnc3 c67e96116703076c6a790a29af7341d4 [0,1,0,1,0,0|2,0,0]=4 974 B18R3.4180 Cc1coc2c1ccc(c2)c3ccncc3 f8c0788898a18c81cd6a2376a1f78f71 [0,1,0,1,0,0|2,0,0]=4 975 B18R3.4180 Cc1csc2c1ccc(c2)c3ccccc3 06c00b0d39b30f2cebe61afc69615ffc [0,1,0,1,0,0|1,1,0]=4 976 B18R3.4180 Cc1noc2c1ccc(c2)c3ccccc3 21410893fe7e976ea1009fd27e4b454b [0,1,0,1,0,0|2,0,0]=4 977 B18R3.4180 Clc1c[nH]c2c1ccc(c2)c3ccccc3 27180288713c6440e63b283686fa7061 [0,1,0,1,0,0|2,0,0]=4 978 B18R3.4180 Fc1c[nH]c2c1ncc(c2)c3ccccc3 693ed2209b4386e572df312413ab1212 [0,1,0,1,0,0|2,0,0]=4 979 B18R3.4180 Fc1csc2c1ccc(c2)c3ccccc3 4ddc582936d4b37091ae0577098ae365 [0,1,0,1,0,0|1,1,0]=4 980 B18R3.4180 Nc1c[nH]c2c1ccc(c2)c3ccccc3 95120cbe0c6f6a09d2c1795bc65478c6 [0,1,0,1,0,0|2,0,0]=4 981 B18R3.4180 Nc1c[nH]c2c1ncc(c2)c3ccccc3 abe37da0c16747ccc8faa46ba26d1288 [0,1,0,1,0,0|2,0,0]=4 982 B18R3.4180 Nc1noc2c1ccc(c2)c3ccccc3 5cb1bb6ada10eb570aab988d4346f267 [0,1,0,1,0,0|2,0,0]=4 983 B18R3.4180 Nc1noc2c1ncc(c2)c3ccccc3 48b2ee3be5098440e8e4eefb8b0adf18 [0,1,0,1,0,0|2,0,0]=4 984 B18R3.4180 O=C1C=Cc2c1ccc(c2)c3ccccc3 8d2d0b4b1a6a29cfeb8e69e517a5b59a [0,1,0,1,0,0|2,0,0]=4 985 B18R3.4180 O=C1COc2c1ccc(c2)c3ccccc3 09ac1e99144ac55ec6687f832ba93aee [0,1,0,1,0,0|1,0,1]=4 986 B18R3.4180 O=c1[nH]oc2c1ccc(c2)c3ccccc3 a768123dfabba10d9178f740ce312cee [0,1,0,1,0,0|2,0,0]=4 987 B18R3.3026 Brc1cc(ccn1)c2ccc3ccoc3c2 2b641cb6b9483c4d748b1e2d143cd423 [0,1,0,1,0,0|2,0,0]=4 988 B18R3.3026 Brc1cc(ccn1)c2cnc3ccoc3c2 9e50b1f02d0a2c6da50892c33d392ce1 [0,1,0,1,0,0|2,0,0]=4 989 B18R3.3026 Brc1cccc(c1)c2ccc3c(c2)CC=C3 1b0d34f858a3833870eeac776791b0ef [0,1,0,1,0,0|2,0,0]=4 990 B18R3.3026 Brc1cccc(c1)c2ccc3cc[nH]c3c2 79b40427070d76399fed98905048e8ac [0,1,0,1,0,0|2,0,0]=4 991 B18R3.3026 Brc1cccc(c1)c2ccc3ccoc3c2 c85eadc9aa8320289c59602d4af2d0c5 [0,1,0,1,0,0|1,0,0]=3 992 B18R3.3026 Brc1cccc(c1)c2ccc3ccoc3n2 f309f950d4ee7154170340eff14041b0 [0,1,0,1,0,0|2,0,0]=4 993 B18R3.3026 Brc1cccc(c1)c2ccc3ccsc3c2 c3d79cc98924c2c9838dbcd9e4e2d33f [0,1,0,1,0,0|1,1,0]=4 994 B18R3.3026 Brc1cccc(c1)c2ccc3cnoc3c2 e7165469c53353dbc2a88f9115143d5c [0,1,0,1,0,0|2,0,0]=4 995 B18R3.3026 Brc1cccc(c1)c2ccc3ncoc3c2 91859260c361ceba684d7da79ad3a230 [0,1,0,1,0,0|2,0,0]=4 996 B18R3.3026 Brc1cccc(c1)c2cnc3cc[nH]c3c2 fdc65229c08df1bd793b3fcca1f41680 [0,1,0,1,0,0|2,0,0]=4 997 B18R3.3026 Brc1cccc(c1)c2cnc3ccoc3c2 75b53f44f19b1477790b2c900ae19912 [0,1,0,1,0,0|1,0,0]=3 998 B18R3.3026 Brc1cccc(c1)c2cnc3ccsc3c2 22d742ef55fd39450ae6e4fc7afb0f27 [0,1,0,1,0,0|1,1,0]=4 999 B18R3.3026 Brc1cccc(c1)c2cnc3ncoc3c2 f85b8f9d498e3998046077f203850b93 [0,1,0,1,0,0|2,0,0]=4 1000 B18R3.3026 Brc1cccc(n1)c2ccc3ccoc3c2 507368f9eda197422ff352d7f9d56951 [0,1,0,1,0,0|2,0,0]=4 1001 B18R3.3026 Brc1cccc(n1)c2cnc3ccoc3c2 bc5936a645566ea7f6e1cb103c86dadf [0,1,0,1,0,0|2,0,0]=4 1002 B18R3.3026 Brc1cncc(c1)c2ccc3ccoc3c2 834d202af3124d2b69a21b981f640d04 [0,1,0,1,0,0|2,0,0]=4 1003 B18R3.3026 Brc1cncc(c1)c2cnc3ccoc3c2 e4aefa1c325823054508d1c46c345b5a [0,1,0,1,0,0|2,0,0]=4 1004 B18R3.3026 Cc1cc(ccn1)c2ccc3ccoc3c2 32fb5b6688459038cabba37145f7126e [0,1,0,1,0,0|2,0,0]=4 1005 B18R3.3026 Cc1cc(ccn1)c2cnc3ccoc3c2 68edba58fa34fc0608cf37cfbe3aa130 [0,1,0,1,0,0|2,0,0]=4 1006 B18R3.3026 Cc1cccc(c1)c2ccc3c(c2)CC=C3 41ca2468a794165ef644e9cb7c9381b9 [0,1,0,1,0,0|2,0,0]=4 1007 B18R3.3026 Cc1cccc(c1)c2ccc3cc[nH]c3c2 fddbb8dab7a8b5a17bf4c9a6dc252539 [0,1,0,1,0,0|2,0,0]=4 1008 B18R3.3026 Cc1cccc(c1)c2ccc3ccoc3c2 5d17247c65d751e14c77ec59a0b3fe1d [0,1,0,1,0,0|1,0,0]=3 1009 B18R3.3026 Cc1cccc(c1)c2ccc3ccoc3n2 70652275170cd30f8fb350befd41c3b9 [0,1,0,1,0,0|2,0,0]=4 1010 B18R3.3026 Cc1cccc(c1)c2ccc3ccsc3c2 836ec3c96a846adcafd20c69dc8e40df [0,1,0,1,0,0|1,1,0]=4 1011 B18R3.3026 Cc1cccc(c1)c2ccc3cnoc3c2 bc04f215293ba5bb791b1cb92ee0b81d [0,1,0,1,0,0|2,0,0]=4 1012 B18R3.3026 Cc1cccc(c1)c2ccc3ncoc3c2 596eb8c94736e319f36a240f41faa58e [0,1,0,1,0,0|2,0,0]=4 1013 B18R3.3026 Cc1cccc(c1)c2cnc3cc[nH]c3c2 e40646cdf209b7623ded8160a923ad48 [0,1,0,1,0,0|2,0,0]=4 1014 B18R3.3026 Cc1cccc(c1)c2cnc3ccoc3c2 9afce1f3480f0c9e4e43cc20353456f0 [0,1,0,1,0,0|1,0,0]=3 1015 B18R3.3026 Cc1cccc(c1)c2cnc3ccsc3c2 8d15d1efe42514461798528ee7eb50f1 [0,1,0,1,0,0|1,1,0]=4 1016 B18R3.3026 Cc1cccc(c1)c2cnc3ncoc3c2 63fcf0ccdd164b59788eb270949ae57a [0,1,0,1,0,0|2,0,0]=4 1017 B18R3.3026 Cc1cccc(n1)c2ccc3ccoc3c2 46aaa4acd0923e759b102168ba7e33c1 [0,1,0,1,0,0|2,0,0]=4 1018 B18R3.3026 Cc1cccc(n1)c2cnc3ccoc3c2 952f5139bf184a64f038d12fb7680397 [0,1,0,1,0,0|2,0,0]=4 1019 B18R3.3026 Cc1ccnc(c1)c2ccc3ccoc3c2 3cd8b15e25ded9f5530f5ddd92b4bfc1 [0,1,0,1,0,0|2,0,0]=4 1020 B18R3.3026 Cc1ccnc(c1)c2cnc3ccoc3c2 93e4447b486ad2ab440e7fe5bda72b61 [0,1,0,1,0,0|2,0,0]=4 1021 B18R3.3026 Cc1cncc(c1)c2ccc3ccoc3c2 14ba361dad1663ea1e8483c921e4df35 [0,1,0,1,0,0|2,0,0]=4 1022 B18R3.3026 Cc1cncc(c1)c2cnc3ccoc3c2 1ef87f7ff0cbf8ae1583d9f1ca1e0791 [0,1,0,1,0,0|2,0,0]=4 1023 B18R3.3026 Clc1cc(ccn1)c2ccc3ccoc3c2 a625b8deadc5f310fff222496ba0ef8a [0,1,0,1,0,0|2,0,0]=4 1024 B18R3.3026 Clc1cc(ccn1)c2cnc3ccoc3c2 dccfee1873f3350985ddcadfba30f42c [0,1,0,1,0,0|2,0,0]=4 1025 B18R3.3026 Clc1cccc(c1)c2ccc3c(c2)CC=C3 9c9e4dd166ee0b950608a664e999a9f0 [0,1,0,1,0,0|2,0,0]=4 1026 B18R3.3026 Clc1cccc(c1)c2ccc3cc[nH]c3c2 cf570261ec3dbfa067495498ce6a304b [0,1,0,1,0,0|2,0,0]=4 1027 B18R3.3026 Clc1cccc(c1)c2ccc3ccoc3c2 5b48ee0c7db4efdcdc25992ce5b7fa65 [0,1,0,1,0,0|1,0,0]=3 1028 B18R3.3026 Clc1cccc(c1)c2ccc3ccoc3n2 7a26e70143155c60029bfcec56ef9a11 [0,1,0,1,0,0|2,0,0]=4 1029 B18R3.3026 Clc1cccc(c1)c2ccc3ccsc3c2 e62dba2e1e3f338f4237b0332c26423b [0,1,0,1,0,0|1,1,0]=4 1030 B18R3.3026 Clc1cccc(c1)c2ccc3cnoc3c2 3be635927f9d66cb33be58d39686d14a [0,1,0,1,0,0|2,0,0]=4 1031 B18R3.3026 Clc1cccc(c1)c2ccc3ncoc3c2 4922e179689abd2d4e2f19ad92156302 [0,1,0,1,0,0|2,0,0]=4 1032 B18R3.3026 Clc1cccc(c1)c2cnc3cc[nH]c3c2 15eaf70aa26204b4233979c7d29e496e [0,1,0,1,0,0|2,0,0]=4 1033 B18R3.3026 Clc1cccc(c1)c2cnc3ccoc3c2 349c2d198ac37d645333519620a6e4e2 [0,1,0,1,0,0|1,0,0]=3 1034 B18R3.3026 Clc1cccc(c1)c2cnc3ccsc3c2 e5483d3f575365c76db9ac36df899f20 [0,1,0,1,0,0|1,1,0]=4 1035 B18R3.3026 Clc1cccc(c1)c2cnc3ncoc3c2 463113acaf1dc285944378ebe3756ce1 [0,1,0,1,0,0|2,0,0]=4 1036 B18R3.3026 Clc1cccc(n1)c2ccc3ccoc3c2 fc723b228b57f5767535ec311075a26e [0,1,0,1,0,0|2,0,0]=4 1037 B18R3.3026 Clc1cccc(n1)c2cnc3ccoc3c2 71a86cbbfa4600232b7162099b150e9b [0,1,0,1,0,0|2,0,0]=4 1038 B18R3.3026 Clc1ccnc(c1)c2ccc3ccoc3c2 6322fc4fbd2a25d131f3bb28b244cbc8 [0,1,0,1,0,0|2,0,0]=4 1039 B18R3.3026 Clc1ccnc(c1)c2cnc3ccoc3c2 8c4fe3fef92cb6536df7abf4c4de108d [0,1,0,1,0,0|2,0,0]=4 1040 B18R3.3026 Clc1cncc(c1)c2ccc3ccoc3c2 5cdff7c71e60f0db279a3d123bf6baa5 [0,1,0,1,0,0|2,0,0]=4 1041 B18R3.3026 Clc1cncc(c1)c2cnc3ccoc3c2 64859437cfed5e796c0cb35d51f6192f [0,1,0,1,0,0|2,0,0]=4 1042 B18R3.3026 Fc1cc(ccn1)c2ccc3ccoc3c2 51e036799483d52a89fd340d9246636a [0,1,0,1,0,0|2,0,0]=4 1043 B18R3.3026 Fc1cc(ccn1)c2cnc3ccoc3c2 785c68e03e31430c4ea7da9e229ee0f5 [0,1,0,1,0,0|2,0,0]=4 1044 B18R3.3026 Fc1cccc(c1)c2ccc3c(c2)CC=C3 735a1f31ee6666d971d7ea62138cbf01 [0,1,0,1,0,0|2,0,0]=4 1045 B18R3.3026 Fc1cccc(c1)c2ccc3cc[nH]c3c2 96ae7018089c0ef782cddbe103fdd057 [0,1,0,1,0,0|2,0,0]=4 1046 B18R3.3026 Fc1cccc(c1)c2ccc3ccoc3c2 48bdef22beb767a4be5ff7d1e80e2caa [0,1,0,1,0,0|1,0,0]=3 1047 B18R3.3026 Fc1cccc(c1)c2ccc3ccoc3n2 1a6c2f09361381e3229c6bf936b9b369 [0,1,0,1,0,0|2,0,0]=4 1048 B18R3.3026 Fc1cccc(c1)c2ccc3ccsc3c2 54844e12ff48316b4157d7e41e9d9843 [0,1,0,1,0,0|1,1,0]=4 1049 B18R3.3026 Fc1cccc(c1)c2ccc3cnoc3c2 88a93ba27719b58b3a166d4b004bff2c [0,1,0,1,0,0|2,0,0]=4 1050 B18R3.3026 Fc1cccc(c1)c2ccc3ncoc3c2 35f914d4be7ad0ee5615eb83e1200975 [0,1,0,1,0,0|2,0,0]=4 1051 B18R3.3026 Fc1cccc(c1)c2cnc3cc[nH]c3c2 7540a71de160ae95f7d48ebe25ba15d3 [0,1,0,1,0,0|2,0,0]=4 1052 B18R3.3026 Fc1cccc(c1)c2cnc3ccoc3c2 aaaff22403215938248421bbb1dc2db2 [0,1,0,1,0,0|1,0,0]=3 1053 B18R3.3026 Fc1cccc(c1)c2cnc3ccsc3c2 4e455a405af1404ef7a425cdc6cb8dc3 [0,1,0,1,0,0|1,1,0]=4 1054 B18R3.3026 Fc1cccc(c1)c2cnc3ncoc3c2 d97a7847a0e514dd1a4e958323f3a92c [0,1,0,1,0,0|2,0,0]=4 1055 B18R3.3026 Fc1cccc(n1)c2ccc3ccoc3c2 01111e1da873f2109dad0a4ab07998a7 [0,1,0,1,0,0|2,0,0]=4 1056 B18R3.3026 Fc1cccc(n1)c2cnc3ccoc3c2 75a8be72485aebc1dc5ef91dbd3ba16c [0,1,0,1,0,0|2,0,0]=4 1057 B18R3.3026 Fc1ccnc(c1)c2ccc3ccoc3c2 6d54c01399d31d28d85eb4da4bb16853 [0,1,0,1,0,0|2,0,0]=4 1058 B18R3.3026 Fc1ccnc(c1)c2cnc3ccoc3c2 8bc4acf183a5b85ee4e5abb425444a00 [0,1,0,1,0,0|2,0,0]=4 1059 B18R3.3026 Fc1cncc(c1)c2ccc3ccoc3c2 2c07ff5c88a308a49d8ee706982c939f [0,1,0,1,0,0|2,0,0]=4 1060 B18R3.3026 Fc1cncc(c1)c2cnc3ccoc3c2 eebd46fd69b89822cd3d34bbb1689cf7 [0,1,0,1,0,0|2,0,0]=4 1061 B18R3.3026 Ic1cccc(c1)c2ccc3c(c2)CC=C3 1e73d89005b26fd522967e9ba5ad2a52 [0,1,0,1,0,0|2,0,0]=4 1062 B18R3.3026 Ic1cccc(c1)c2ccc3cc[nH]c3c2 61321785d7176908c5d71056c066d1d3 [0,1,0,1,0,0|2,0,0]=4 1063 B18R3.3026 Ic1cccc(c1)c2ccc3ccoc3c2 22a28fac8d31e0551d87fbbb914b66c9 [0,1,0,1,0,0|1,0,0]=3 1064 B18R3.3026 Ic1cccc(c1)c2ccc3ccoc3n2 f530c9868485510b03e46c8d75376ffb [0,1,0,1,0,0|2,0,0]=4 1065 B18R3.3026 Ic1cccc(c1)c2ccc3ccsc3c2 e150f2b3f88862a13504bda82579e852 [0,1,0,1,0,0|1,1,0]=4 1066 B18R3.3026 Ic1cccc(c1)c2ccc3cnoc3c2 575332829cf68dc51347754a7f5d100f [0,1,0,1,0,0|2,0,0]=4 1067 B18R3.3026 Ic1cccc(c1)c2ccc3ncoc3c2 dd3142da274cb329aaeeb736ba8e9730 [0,1,0,1,0,0|2,0,0]=4 1068 B18R3.3026 Ic1cccc(c1)c2cnc3cc[nH]c3c2 e188197f5f7fdd9fb06c866e633db71d [0,1,0,1,0,0|2,0,0]=4 1069 B18R3.3026 Ic1cccc(c1)c2cnc3ccoc3c2 27d1fb579e3d9193a1dbec86f7514431 [0,1,0,1,0,0|1,0,0]=3 1070 B18R3.3026 Ic1cccc(c1)c2cnc3ccsc3c2 2cb8cf0a53e3d28eadd14b14525dedb2 [0,1,0,1,0,0|1,1,0]=4 1071 B18R3.3026 Ic1cccc(c1)c2cnc3ncoc3c2 79ee94a8e07643e5f422952007e7374a [0,1,0,1,0,0|2,0,0]=4 1072 B18R3.3026 Nc1cc(ccn1)c2ccc3ccoc3c2 dffe5192d7639e7687049e35d6be225d [0,1,0,1,0,0|2,0,0]=4 1073 B18R3.3026 Nc1cc(ccn1)c2cnc3ccoc3c2 2a86c82ae57a5c82f887b36683797541 [0,1,0,1,0,0|2,0,0]=4 1074 B18R3.3026 Nc1cccc(c1)c2ccc3cc[nH]c3c2 ac875bcd25d7efb672c431dd38483fad [0,1,0,1,0,0|2,0,0]=4 1075 B18R3.3026 Nc1cccc(c1)c2ccc3ccoc3c2 fdc5fd258e958771f39ca5bbe368e533 [0,1,0,1,0,0|1,0,0]=3 1076 B18R3.3026 Nc1cccc(c1)c2ccc3ccsc3c2 a84f62b945801da82db933ef2442f17b [0,1,0,1,0,0|1,1,0]=4 1077 B18R3.3026 Nc1cccc(c1)c2ccc3ncoc3c2 80e424132a161dcf69d1289f58c86506 [0,1,0,1,0,0|2,0,0]=4 1078 B18R3.3026 Nc1cccc(c1)c2cnc3cc[nH]c3c2 998c8f44cab3e765dcb9cd5937c2900b [0,1,0,1,0,0|2,0,0]=4 1079 B18R3.3026 Nc1cccc(c1)c2cnc3ccoc3c2 b440145e5d93d2fa3eb0331ebec57d68 [0,1,0,1,0,0|1,0,0]=3 1080 B18R3.3026 Nc1cccc(c1)c2cnc3ccsc3c2 1a29a73e198a5e8a5f854675b63cd88c [0,1,0,1,0,0|1,1,0]=4 1081 B18R3.3026 Nc1cccc(n1)c2ccc3ccoc3c2 22ea32a7d77288549e92129ff67b3ec4 [0,1,0,1,0,0|2,0,0]=4 1082 B18R3.3026 Nc1cccc(n1)c2cnc3ccoc3c2 5eb5b7dffec5b6d1901035397b5fd259 [0,1,0,1,0,0|2,0,0]=4 1083 B18R3.3026 Nc1ccnc(c1)c2ccc3ccoc3c2 4d758392c71c160ead956986f403b9d0 [0,1,0,1,0,0|2,0,0]=4 1084 B18R3.3026 Nc1ccnc(c1)c2cnc3ccoc3c2 28172db000dde42e1281dbe527d5cbe4 [0,1,0,1,0,0|2,0,0]=4 1085 B18R3.3026 Nc1cncc(c1)c2ccc3ccoc3c2 afb0b841e335457c2ec742626e27bf41 [0,1,0,1,0,0|2,0,0]=4 1086 B18R3.3026 Nc1cncc(c1)c2cnc3ccoc3c2 eb56a6c40c37110953f1acb07bd14452 [0,1,0,1,0,0|2,0,0]=4 1087 B18R3.3026 O=c1cccc([nH]1)c2cnc3ccoc3c2 a733d7cbf7b6913e3e9bb9513f8d54fc [0,1,0,1,0,0|2,0,0]=4 1088 B18R3.3026 Oc1cc(ccn1)c2ccc3ccoc3c2 178998dcf2ecf5e62798ef760845a729 [0,1,0,1,0,0|2,0,0]=4 1089 B18R3.3026 Oc1cc(ccn1)c2cnc3ccoc3c2 9fdfe41be967b8bfce30dc1b1e75b5f5 [0,1,0,1,0,0|2,0,0]=4 1090 B18R3.3026 Oc1cccc(c1)c2ccc3c(c2)CC=C3 38cbaada7580f62042029996d161852e [0,1,0,1,0,0|2,0,0]=4 1091 B18R3.3026 Oc1cccc(c1)c2ccc3cc[nH]c3c2 75cc22eed20dd194f282ec437860a63f [0,1,0,1,0,0|2,0,0]=4 1092 B18R3.3026 Oc1cccc(c1)c2ccc3ccoc3c2 804e8fccbc5e34be7a629f1bfd890ada [0,1,0,1,0,0|1,0,0]=3 1093 B18R3.3026 Oc1cccc(c1)c2ccc3ccoc3n2 e1c4672c95bd15180683e6e4874d00f8 [0,1,0,1,0,0|2,0,0]=4 1094 B18R3.3026 Oc1cccc(c1)c2ccc3ccsc3c2 da0dd56de98625ba7ee92ae5db1c9306 [0,1,0,1,0,0|1,1,0]=4 1095 B18R3.3026 Oc1cccc(c1)c2ccc3cnoc3c2 68fdd19582d56f0b412d6ed7bb0042c7 [0,1,0,1,0,0|2,0,0]=4 1096 B18R3.3026 Oc1cccc(c1)c2ccc3ncoc3c2 7109be9b4727138c2301b07bb467057d [0,1,0,1,0,0|2,0,0]=4 1097 B18R3.3026 Oc1cccc(c1)c2cnc3cc[nH]c3c2 0aaf08a04b5c8bbc9bdb745a86d7d073 [0,1,0,1,0,0|2,0,0]=4 1098 B18R3.3026 Oc1cccc(c1)c2cnc3ccoc3c2 e50dd1f2ce0b94298aac87f8e9423c25 [0,1,0,1,0,0|1,0,0]=3 1099 B18R3.3026 Oc1cccc(c1)c2cnc3ccsc3c2 111a5429315b4cca55fdaa457a2d1d74 [0,1,0,1,0,0|1,1,0]=4 1100 B18R3.3026 Oc1cccc(c1)c2cnc3ncoc3c2 8d523e8f38669e638f6dab113ef05774 [0,1,0,1,0,0|2,0,0]=4 1101 B18R3.3026 Oc1cccc(n1)c2ccc3ccoc3c2 7722c607cb8c721cf06cada66bfde3bd [0,1,0,1,0,0|2,0,0]=4 1102 B18R3.3026 Oc1ccnc(c1)c2ccc3ccoc3c2 c25d97e8819ca000e700426f793b62f6 [0,1,0,1,0,0|2,0,0]=4 1103 B18R3.3026 Oc1ccnc(c1)c2cnc3ccoc3c2 c04c3756ddd0102c17e013df46c35c26 [0,1,0,1,0,0|2,0,0]=4 1104 B18R3.3026 Oc1cncc(c1)c2ccc3ccoc3c2 53471a117e14d5e40f1847d77c2739b4 [0,1,0,1,0,0|2,0,0]=4 1105 B18R3.3026 Oc1cncc(c1)c2cnc3ccoc3c2 4ee148879a2c647479a8c89c7adcf422 [0,1,0,1,0,0|2,0,0]=4 1106 B18R3.3026 Sc1cccc(c1)c2ccc3c(c2)CC=C3 c4a0120c1a141225d4072ae83bd90b96 [0,1,0,1,0,0|2,0,0]=4 1107 B18R3.3026 Sc1cccc(c1)c2ccc3cc[nH]c3c2 ef63ddfefdeb550123d8032d32945f59 [0,1,0,1,0,0|2,0,0]=4 1108 B18R3.3026 Sc1cccc(c1)c2ccc3ccoc3c2 67fa1af076f2a6de2349911b1d936e36 [0,1,0,1,0,0|1,0,0]=3 1109 B18R3.3026 Sc1cccc(c1)c2ccc3ccoc3n2 451f5c7efa615538146b45c2bce9e709 [0,1,0,1,0,0|2,0,0]=4 1110 B18R3.3026 Sc1cccc(c1)c2ccc3ccsc3c2 665f54b832dcacda9045afb626255f88 [0,1,0,1,0,0|1,1,0]=4 1111 B18R3.3026 Sc1cccc(c1)c2ccc3cnoc3c2 d925f93c124f9b55b62d4aeef6cbed08 [0,1,0,1,0,0|2,0,0]=4 1112 B18R3.3026 Sc1cccc(c1)c2ccc3ncoc3c2 05c7ed0c33a7ddcb6ba55958d12cd695 [0,1,0,1,0,0|2,0,0]=4 1113 B18R3.3026 Sc1cccc(c1)c2cnc3cc[nH]c3c2 1fd5060f718f46c9077b75ad991bb955 [0,1,0,1,0,0|2,0,0]=4 1114 B18R3.3026 Sc1cccc(c1)c2cnc3ccoc3c2 32cc6d059e211cee165a484be4bec700 [0,1,0,1,0,0|1,0,0]=3 1115 B18R3.3026 Sc1cccc(c1)c2cnc3ccsc3c2 af1d832f77c53d743121363ab2a748c5 [0,1,0,1,0,0|1,1,0]=4 1116 B18R3.3026 Sc1cccc(c1)c2cnc3ncoc3c2 49c7d6130a7ea643de8ebd4c1c4fb28a [0,1,0,1,0,0|2,0,0]=4 1117 B18R3.3026 [O-][n+]1cccc(c1)c2ccc3ccoc3c2 c9a2f9170af26ceb217caeb8ae6e3e12 [0,1,0,1,0,0|2,0,0]=4 1118 B18R3.3026 [O-][n+]1cccc(c1)c2cnc3ccoc3c2 9026d8852af6a5d85fda50b4122f6221 [0,1,0,1,0,0|2,0,0]=4 1119 B18R3.171 Cc1cc2cc[nH]c2cc1c3ccccc3 430970fbb492bf4702917c9fb63f6047 [0,1,0,1,0,0|2,0,0]=4 1120 B18R3.171 Cc1cc2ccsc2cc1c3ccccc3 99de867eeadd9321aa2a98930ae71e29 [0,1,0,1,0,0|1,1,0]=4 1121 B18R3.171 Cc1cc2ncoc2cc1c3ccccc3 5e2f01309da9ced904230f61c6c3db4f [0,1,0,1,0,0|2,0,0]=4 1122 B18R3.171 Fc1cc2cc[nH]c2cc1c3ccccc3 45bf7965a3ec5a913335444d4fc1c09e [0,1,0,1,0,0|2,0,0]=4 1123 B18R3.171 Fc1cc2ncoc2cc1c3ccccc3 ca2d3676159b8fda0af1645d83877042 [0,1,0,1,0,0|2,0,0]=4 1124 B18R3.171 Nc1cc2cc[nH]c2cc1c3ccccc3 b5aed3dde1ab9baef3a2d11d22647b27 [0,1,0,1,0,0|2,0,0]=4 1125 B18R3.171 Oc1cc2cc[nH]c2cc1c3ccccc3 f6912565323b6d338e3b4151b689856a [0,1,0,1,0,0|1,0,1]=4 1126 B18R3.53542 Cn1ccc2c1cc(cc2)c3ccccc3 2a9a94d7c49577c347d1073d7391e418 [0,1,0,1,0,0|2,0,0]=4 1127 B18R3.53542 Cn1ccc2c1cc(cn2)c3ccccc3 f247aecdfe2e65e9f4e8b69e60697e26 [0,1,0,1,0,0|2,0,0]=4 1128 B18R3.6371 O=C1Nc2ccccc2C1Oc3ccco3 13c64fc23bc571d8e5f8d3d4d404b561 [0,1,0,1,0,0|1,0,1]=4 1129 B18R3.3958 Brc1ccccc1c2ccc3c(c2)CC=C3 37a21926b189b1cc1ef030ebda04a5b3 [0,1,0,1,0,0|2,0,0]=4 1130 B18R3.3958 Brc1ccccc1c2ccc3cc[nH]c3c2 a4a728a1d4c9ffd848cf6c4be387b400 [0,1,0,1,0,0|2,0,0]=4 1131 B18R3.3958 Brc1ccccc1c2ccc3ccoc3c2 6c573aba026cd73c12fbb0de786c8be5 [0,1,0,1,0,0|1,0,0]=3 1132 B18R3.3958 Brc1ccccc1c2ccc3ccsc3c2 7459b64418335a0ebc0f8df4571e44d2 [0,1,0,1,0,0|1,1,0]=4 1133 B18R3.3958 Brc1ccccc1c2ccc3cnoc3c2 9e12fe0de0befd39b545ea83f1ab1fd0 [0,1,0,1,0,0|2,0,0]=4 1134 B18R3.3958 Brc1ccccc1c2ccc3ncoc3c2 1c27cacea892ee6f84c574e7a0af5c7f [0,1,0,1,0,0|2,0,0]=4 1135 B18R3.3958 Brc1ccccc1c2cnc3cc[nH]c3c2 23e34e1db1578247dcc1a2a309e0a004 [0,1,0,1,0,0|2,0,0]=4 1136 B18R3.3958 Brc1ccccc1c2cnc3ccoc3c2 97afaafe65ca319807437bdafbb98968 [0,1,0,1,0,0|1,0,0]=3 1137 B18R3.3958 Brc1ccccc1c2cnc3ccsc3c2 4a9c64ad809b9ab2a12bcbb6f3bb4fad [0,1,0,1,0,0|1,1,0]=4 1138 B18R3.3958 Brc1ccccc1c2cnc3ncoc3c2 18c5313934fd816a008f4acf91182c7e [0,1,0,1,0,0|2,0,0]=4 1139 B18R3.3958 Brc1ccncc1c2ccc3ccoc3c2 f79282bb19cb427aadd17516b13c1d37 [0,1,0,1,0,0|2,0,0]=4 1140 B18R3.3958 Brc1ccncc1c2cnc3ccoc3c2 9bf70cd1e90d4dd20115584d08e41c6a [0,1,0,1,0,0|2,0,0]=4 1141 B18R3.3958 Brc1cnccc1c2ccc3ccoc3c2 625e870b1ff702f0d47df3a7c041a895 [0,1,0,1,0,0|2,0,0]=4 1142 B18R3.3958 Brc1cnccc1c2cnc3ccoc3c2 630eb2b954c8013fc63f01e03ef96889 [0,1,0,1,0,0|2,0,0]=4 1143 B18R3.3958 Brc1ncccc1c2ccc3ccoc3c2 b5b1bdc591a8d1b8ed071ba564e65614 [0,1,0,1,0,0|2,0,0]=4 1144 B18R3.3958 Brc1ncccc1c2cnc3ccoc3c2 b95a23120b468a05ea88f526ba8487cc [0,1,0,1,0,0|2,0,0]=4 1145 B18R3.3958 Cc1ccccc1c2ccc3c(c2)CC=C3 7819f37c8d1df32c1b185bec139681ce [0,1,0,1,0,0|2,0,0]=4 1146 B18R3.3958 Cc1ccccc1c2ccc3cc[nH]c3c2 6526ccfae704b5c2279095884e8c944d [0,1,0,1,0,0|2,0,0]=4 1147 B18R3.3958 Cc1ccccc1c2ccc3ccoc3c2 ed8d961353446ec9420616818873d899 [0,1,0,1,0,0|1,0,0]=3 1148 B18R3.3958 Cc1ccccc1c2ccc3ccoc3n2 dfa1640fba3292db5e4693bdd5c91da8 [0,1,0,1,0,0|2,0,0]=4 1149 B18R3.3958 Cc1ccccc1c2ccc3ccsc3c2 9b783b6c1010c76ae884ff56eb541b83 [0,1,0,1,0,0|1,1,0]=4 1150 B18R3.3958 Cc1ccccc1c2ccc3cnoc3c2 04c8d63f22b7800ec112543f29c5c9f1 [0,1,0,1,0,0|2,0,0]=4 1151 B18R3.3958 Cc1ccccc1c2ccc3ncoc3c2 5b11bf57b792e4be3091763333f7e7dc [0,1,0,1,0,0|2,0,0]=4 1152 B18R3.3958 Cc1ccccc1c2cnc3cc[nH]c3c2 c2026757cc8372b99747a249f7fe5274 [0,1,0,1,0,0|2,0,0]=4 1153 B18R3.3958 Cc1ccccc1c2cnc3ccoc3c2 79493a5f4a505b30e00a4d006ee2bb50 [0,1,0,1,0,0|1,0,0]=3 1154 B18R3.3958 Cc1ccccc1c2cnc3ccsc3c2 2cc6a8177d7d041e1a0ff92c453da74f [0,1,0,1,0,0|1,1,0]=4 1155 B18R3.3958 Cc1ccccc1c2cnc3ncoc3c2 2f1685ebed5c80caa84f1cf67465ab0e [0,1,0,1,0,0|2,0,0]=4 1156 B18R3.3958 Cc1cccnc1c2ccc3ccoc3c2 1dc66d88873b8a3216619e43bd97650a [0,1,0,1,0,0|2,0,0]=4 1157 B18R3.3958 Cc1cccnc1c2cnc3ccoc3c2 254ce9a542d164e36ded74221562e95c [0,1,0,1,0,0|2,0,0]=4 1158 B18R3.3958 Cc1ccncc1c2ccc3ccoc3c2 f2b8884cdab762ba1ed6e048c7a76937 [0,1,0,1,0,0|2,0,0]=4 1159 B18R3.3958 Cc1ccncc1c2cnc3ccoc3c2 c4cc1613b9df6fbbe12ddefdf09a2ff2 [0,1,0,1,0,0|2,0,0]=4 1160 B18R3.3958 Cc1cnccc1c2ccc3ccoc3c2 3967f5920425f2078a457a1019f5b274 [0,1,0,1,0,0|2,0,0]=4 1161 B18R3.3958 Cc1cnccc1c2cnc3ccoc3c2 0a361169ba90b416a3f094ecdfc4e5ec [0,1,0,1,0,0|2,0,0]=4 1162 B18R3.3958 Cc1ncccc1c2ccc3ccoc3c2 21800706f646aa78c003c14e60fd2bb7 [0,1,0,1,0,0|2,0,0]=4 1163 B18R3.3958 Cc1ncccc1c2cnc3ccoc3c2 e41aff72adc1849a29898c903c0ef4fe [0,1,0,1,0,0|2,0,0]=4 1164 B18R3.3958 Clc1ccccc1c2ccc3c(c2)CC=C3 381e26f02d6ffca40ed4cf80386a4be2 [0,1,0,1,0,0|2,0,0]=4 1165 B18R3.3958 Clc1ccccc1c2ccc3cc[nH]c3c2 7358acafb70f996f9c5b9b469c1a7ff5 [0,1,0,1,0,0|2,0,0]=4 1166 B18R3.3958 Clc1ccccc1c2ccc3ccoc3c2 0fcfafa2ba4ee651542256ac0a1faa01 [0,1,0,1,0,0|1,0,0]=3 1167 B18R3.3958 Clc1ccccc1c2ccc3ccoc3n2 bc1472ed7af6306dd1221acfcf0fb0e7 [0,1,0,1,0,0|2,0,0]=4 1168 B18R3.3958 Clc1ccccc1c2ccc3ccsc3c2 1a0d1c985ac60e4c7a1f255a4cf72274 [0,1,0,1,0,0|1,1,0]=4 1169 B18R3.3958 Clc1ccccc1c2ccc3cnoc3c2 174e78dfd01e60afc85551b6959b8f65 [0,1,0,1,0,0|2,0,0]=4 1170 B18R3.3958 Clc1ccccc1c2ccc3ncoc3c2 368acdaf9d3160d5276c3d308e8685d1 [0,1,0,1,0,0|2,0,0]=4 1171 B18R3.3958 Clc1ccccc1c2cnc3cc[nH]c3c2 8ea75d50b100fc95cb41412985c8501b [0,1,0,1,0,0|2,0,0]=4 1172 B18R3.3958 Clc1ccccc1c2cnc3ccoc3c2 32ad1fa399dd6320b1b56fbab02ce388 [0,1,0,1,0,0|1,0,0]=3 1173 B18R3.3958 Clc1ccccc1c2cnc3ccsc3c2 0d95cb1f6106a1563976831e1967a081 [0,1,0,1,0,0|1,1,0]=4 1174 B18R3.3958 Clc1ccccc1c2cnc3ncoc3c2 61079c07ba2a5f54b2f794dab3296117 [0,1,0,1,0,0|2,0,0]=4 1175 B18R3.3958 Clc1cccnc1c2ccc3ccoc3c2 f3a498b10dbd882c9ac3a6e601c5e1aa [0,1,0,1,0,0|2,0,0]=4 1176 B18R3.3958 Clc1cccnc1c2cnc3ccoc3c2 f415660b7eb8765ca2bc7326fd1ac866 [0,1,0,1,0,0|2,0,0]=4 1177 B18R3.3958 Clc1ccncc1c2ccc3ccoc3c2 d00a8cb3dd44b87bec1bb18c23a343c7 [0,1,0,1,0,0|2,0,0]=4 1178 B18R3.3958 Clc1ccncc1c2cnc3ccoc3c2 ea246ad3656d2a399159925e4ba2c4fd [0,1,0,1,0,0|2,0,0]=4 1179 B18R3.3958 Clc1cnccc1c2ccc3ccoc3c2 f87f05164b248237fff06848f56c88f7 [0,1,0,1,0,0|2,0,0]=4 1180 B18R3.3958 Clc1cnccc1c2cnc3ccoc3c2 1d1cd640f10208900939c423861dcd32 [0,1,0,1,0,0|2,0,0]=4 1181 B18R3.3958 Clc1ncccc1c2ccc3ccoc3c2 bfe256c155ab0f50cf242f2de830c6c4 [0,1,0,1,0,0|2,0,0]=4 1182 B18R3.3958 Clc1ncccc1c2cnc3ccoc3c2 332408f595ecf0b38879b6e6e7ab1ce7 [0,1,0,1,0,0|2,0,0]=4 1183 B18R3.3958 Fc1ccccc1c2ccc3c(c2)CC=C3 1ce9f909e9589b3e6511fa42d7f86cd4 [0,1,0,1,0,0|2,0,0]=4 1184 B18R3.3958 Fc1ccccc1c2ccc3cc[nH]c3c2 091c50e7d0b7a41bb24526888cbbaf47 [0,1,0,1,0,0|2,0,0]=4 1185 B18R3.3958 Fc1ccccc1c2ccc3ccoc3c2 67490d726aa1031f3007415045287c65 [0,1,0,1,0,0|1,0,0]=3 1186 B18R3.3958 Fc1ccccc1c2ccc3ccoc3n2 e0a065fcc811246094361efda1fb05b2 [0,1,0,1,0,0|2,0,0]=4 1187 B18R3.3958 Fc1ccccc1c2ccc3ccsc3c2 a59cbc5bea45398c95b0acef569baf8d [0,1,0,1,0,0|1,1,0]=4 1188 B18R3.3958 Fc1ccccc1c2ccc3cnoc3c2 454fe8513e129f0ba2175a1c3509e750 [0,1,0,1,0,0|2,0,0]=4 1189 B18R3.3958 Fc1ccccc1c2ccc3ncoc3c2 1ada7efdeb48880a904597b22c8680b9 [0,1,0,1,0,0|2,0,0]=4 1190 B18R3.3958 Fc1ccccc1c2cnc3cc[nH]c3c2 6cfa92bbcfb5e71f20a0b8789161736c [0,1,0,1,0,0|2,0,0]=4 1191 B18R3.3958 Fc1ccccc1c2cnc3ccoc3c2 17c14f337fe5dd63e69e32488f0214f5 [0,1,0,1,0,0|1,0,0]=3 1192 B18R3.3958 Fc1ccccc1c2cnc3ccsc3c2 40bf4d30ec19ac97324714fd1dc99b96 [0,1,0,1,0,0|1,1,0]=4 1193 B18R3.3958 Fc1ccccc1c2cnc3ncoc3c2 9160120e1c4390bb80e3c2ab663cd490 [0,1,0,1,0,0|2,0,0]=4 1194 B18R3.3958 Fc1cccnc1c2ccc3ccoc3c2 bc526b7fde16e787e295ac9427488a94 [0,1,0,1,0,0|2,0,0]=4 1195 B18R3.3958 Fc1cccnc1c2cnc3ccoc3c2 47400d21a6b8e1e161fe23ffa1c769ea [0,1,0,1,0,0|2,0,0]=4 1196 B18R3.3958 Fc1ccncc1c2ccc3ccoc3c2 2cc972504a66e36d774d211d0dcc0c81 [0,1,0,1,0,0|2,0,0]=4 1197 B18R3.3958 Fc1ccncc1c2cnc3ccoc3c2 a650e048d8446728a844cb5b8c7c7f5f [0,1,0,1,0,0|2,0,0]=4 1198 B18R3.3958 Fc1cnccc1c2ccc3ccoc3c2 b88fe2377a7cdbfb912f301484f740c4 [0,1,0,1,0,0|2,0,0]=4 1199 B18R3.3958 Fc1cnccc1c2cnc3ccoc3c2 99de8fcbab4ef4d28ed4b6fc0182ee00 [0,1,0,1,0,0|2,0,0]=4 1200 B18R3.3958 Fc1ncccc1c2ccc3ccoc3c2 6a4d42eeb67c65745b344b8ec3fe8caa [0,1,0,1,0,0|2,0,0]=4 1201 B18R3.3958 Fc1ncccc1c2cnc3ccoc3c2 58e478941b0c89534c26208ea7b9a22e [0,1,0,1,0,0|2,0,0]=4 1202 B18R3.3958 Ic1ccccc1c2ccc3c(c2)CC=C3 53136184ebb318a34269291136693280 [0,1,0,1,0,0|2,0,0]=4 1203 B18R3.3958 Ic1ccccc1c2ccc3cc[nH]c3c2 5a60ca4c57dd7cbf11d5cfb0cd37d792 [0,1,0,1,0,0|2,0,0]=4 1204 B18R3.3958 Ic1ccccc1c2ccc3ccoc3c2 148ba75b61d16ebec5f0da1e79a3a467 [0,1,0,1,0,0|1,0,0]=3 1205 B18R3.3958 Ic1ccccc1c2ccc3ccoc3n2 3892a0a86d6856faea4065166a402405 [0,1,0,1,0,0|2,0,0]=4 1206 B18R3.3958 Ic1ccccc1c2ccc3ccsc3c2 50eb90211cb4fab40163e6c16145001c [0,1,0,1,0,0|1,1,0]=4 1207 B18R3.3958 Ic1ccccc1c2ccc3cnoc3c2 7632e51dfd22d334e39ae1eb6b00b9e6 [0,1,0,1,0,0|2,0,0]=4 1208 B18R3.3958 Ic1ccccc1c2ccc3ncoc3c2 59d205cd12f86f69dd88fbcdd3bec68d [0,1,0,1,0,0|2,0,0]=4 1209 B18R3.3958 Ic1ccccc1c2cnc3cc[nH]c3c2 ff59cce157ec983955636e44195877f3 [0,1,0,1,0,0|2,0,0]=4 1210 B18R3.3958 Ic1ccccc1c2cnc3ccoc3c2 74509b59abfd3a17a1ba27c23e700380 [0,1,0,1,0,0|1,0,0]=3 1211 B18R3.3958 Ic1ccccc1c2cnc3ccsc3c2 704d60fd0700d34bbfa3bebf7688316c [0,1,0,1,0,0|1,1,0]=4 1212 B18R3.3958 Ic1ccccc1c2cnc3ncoc3c2 d8d58bcf638fb45a415b1c171e702c59 [0,1,0,1,0,0|2,0,0]=4 1213 B18R3.3958 Nc1ccccc1c2ccc3cc[nH]c3c2 48babc8a0ed2f87dbe9df528873f0f22 [0,1,0,1,0,0|2,0,0]=4 1214 B18R3.3958 Nc1ccccc1c2ccc3ccoc3c2 0792e5247965c75d26f9cfbbbc67c0c4 [0,1,0,1,0,0|1,0,0]=3 1215 B18R3.3958 Nc1ccccc1c2ccc3ccsc3c2 53e9c6a4907d96043264a4fbf15d6932 [0,1,0,1,0,0|1,1,0]=4 1216 B18R3.3958 Nc1ccccc1c2ccc3ncoc3c2 68d698d5f7a07137c07143875f1c6a44 [0,1,0,1,0,0|2,0,0]=4 1217 B18R3.3958 Nc1ccccc1c2cnc3cc[nH]c3c2 adf51c19fd39df4edf8f3cf1a3a04aa0 [0,1,0,1,0,0|2,0,0]=4 1218 B18R3.3958 Nc1ccccc1c2cnc3ccoc3c2 65cc6ab341db4af557df6b8d727254dd [0,1,0,1,0,0|1,0,0]=3 1219 B18R3.3958 Nc1ccccc1c2cnc3ccsc3c2 53c725c4be85ed33a63ae4fd8f90cd2c [0,1,0,1,0,0|1,1,0]=4 1220 B18R3.3958 Nc1cccnc1c2ccc3ccoc3c2 2dca9d56795aab29f16aa45494ffaba4 [0,1,0,1,0,0|2,0,0]=4 1221 B18R3.3958 Nc1cccnc1c2cnc3ccoc3c2 7e6f413658d43729d501fad72650a4b0 [0,1,0,1,0,0|2,0,0]=4 1222 B18R3.3958 Nc1ccncc1c2ccc3ccoc3c2 cdcc96c865264e1227ea9bfb6c347898 [0,1,0,1,0,0|2,0,0]=4 1223 B18R3.3958 Nc1ccncc1c2cnc3ccoc3c2 ede08656fd37842a8bf0bdd48dfe383e [0,1,0,1,0,0|2,0,0]=4 1224 B18R3.3958 Nc1cnccc1c2ccc3ccoc3c2 ef240e72b57e85f742a4231f06f2ea47 [0,1,0,1,0,0|2,0,0]=4 1225 B18R3.3958 Nc1cnccc1c2cnc3ccoc3c2 1ea114d27fb012de11e77980a66c36b0 [0,1,0,1,0,0|2,0,0]=4 1226 B18R3.3958 Nc1ncccc1c2ccc3ccoc3c2 a828f9c27bb8ee8f83f6e3f2a85afb96 [0,1,0,1,0,0|2,0,0]=4 1227 B18R3.3958 Nc1ncccc1c2cnc3ccoc3c2 af349c938738b3e54a082d2b7d1dbcff [0,1,0,1,0,0|2,0,0]=4 1228 B18R3.3958 O=c1[nH]cccc1c2ccc3ccoc3c2 b804fe4d36d354cf193e0e89cb78fb6a [0,1,0,1,0,0|2,0,0]=4 1229 B18R3.3958 O=c1[nH]cccc1c2cnc3ccoc3c2 f30a4a89fd7950098c0d04b262178253 [0,1,0,1,0,0|2,0,0]=4 1230 B18R3.3958 O=c1occcc1c2ccc3ccoc3c2 977b5de86efc43921436b20c71478b07 [0,1,0,1,0,0|2,0,0]=4 1231 B18R3.3958 O=c1occcc1c2cnc3ccoc3c2 df8920b067da4d8d63332bf142727442 [0,1,0,1,0,0|2,0,0]=4 1232 B18R3.3958 Oc1ccccc1c2ccc3c(c2)CC=C3 c3aa2eb228d3f1947f72065e38048279 [0,1,0,1,0,0|2,0,0]=4 1233 B18R3.3958 Oc1ccccc1c2ccc3cc[nH]c3c2 68c55018346d58217ff169639eff644d [0,1,0,1,0,0|2,0,0]=4 1234 B18R3.3958 Oc1ccccc1c2ccc3ccoc3c2 1b7132d0004ba513c62a5993e5f91c30 [0,1,0,1,0,0|1,0,0]=3 1235 B18R3.3958 Oc1ccccc1c2ccc3ccoc3n2 7fff1709502ff0d9c2d55577d482aabf [0,1,0,1,0,0|2,0,0]=4 1236 B18R3.3958 Oc1ccccc1c2ccc3ccsc3c2 db991d9bb1de9677570a004ea14e1d99 [0,1,0,1,0,0|1,1,0]=4 1237 B18R3.3958 Oc1ccccc1c2ccc3cnoc3c2 4615aa5272d2dd60120b12392b0e5f6f [0,1,0,1,0,0|2,0,0]=4 1238 B18R3.3958 Oc1ccccc1c2ccc3ncoc3c2 8620575c02d5f089974454a1ea11137a [0,1,0,1,0,0|2,0,0]=4 1239 B18R3.3958 Oc1ccccc1c2cnc3cc[nH]c3c2 8a41f6bee6d12f8d66c282f9999e4754 [0,1,0,1,0,0|2,0,0]=4 1240 B18R3.3958 Oc1ccccc1c2cnc3ccoc3c2 c080edb0798aa4ea7b98e1a32dff269b [0,1,0,1,0,0|1,0,0]=3 1241 B18R3.3958 Oc1ccccc1c2cnc3ccsc3c2 8a919e30734b4f7deb4ba83fedaca8e9 [0,1,0,1,0,0|1,1,0]=4 1242 B18R3.3958 Oc1ccccc1c2cnc3ncoc3c2 4d8d1cbc2c68c26d04bd261cd7935c03 [0,1,0,1,0,0|2,0,0]=4 1243 B18R3.3958 Oc1cccnc1c2ccc3ccoc3c2 a7ab8d9a4b50c3f3fdba34040ea0a16d [0,1,0,1,0,0|2,0,0]=4 1244 B18R3.3958 Oc1cccnc1c2cnc3ccoc3c2 320ffc1b7557cb4ff550ecd33d6a723f [0,1,0,1,0,0|2,0,0]=4 1245 B18R3.3958 Oc1ccncc1c2ccc3ccoc3c2 c9cbda9e66aab0fe858efea7b37a6472 [0,1,0,1,0,0|2,0,0]=4 1246 B18R3.3958 Oc1ccncc1c2cnc3ccoc3c2 edc11c496389d9e174ab065e06866d47 [0,1,0,1,0,0|2,0,0]=4 1247 B18R3.3958 Oc1cnccc1c2ccc3ccoc3c2 46dfed146b174ee421941576d5fe4acb [0,1,0,1,0,0|2,0,0]=4 1248 B18R3.3958 Oc1cnccc1c2cnc3ccoc3c2 3bc8e24d6491e6588789d2bf3857bdbd [0,1,0,1,0,0|2,0,0]=4 1249 B18R3.3958 S=c1[nH]cccc1c2ccc3ccoc3c2 1c404b72154520cec6c2678d82c258bf [0,1,0,1,0,0|2,0,0]=4 1250 B18R3.3958 S=c1[nH]cccc1c2cnc3ccoc3c2 c5d1527a37fe7cbb9b6a15dbe650dac4 [0,1,0,1,0,0|2,0,0]=4 1251 B18R3.3958 S=c1cc[nH]cc1c2cnc3ccoc3c2 7413c340463f31766a7a9fe16bcec91e [0,1,0,1,0,0|2,0,0]=4 1252 B18R3.3958 Sc1ccccc1c2ccc3cc[nH]c3c2 591edc91541502d19397a1041bc216d9 [0,1,0,1,0,0|2,0,0]=4 1253 B18R3.3958 Sc1ccccc1c2ccc3ccoc3c2 ecb8a07b812a8dcefabfc69a25002d3b [0,1,0,1,0,0|1,0,0]=3 1254 B18R3.3958 Sc1ccccc1c2ccc3ccsc3c2 6e496bbf65ec17b7129d45e17c809d44 [0,1,0,1,0,0|1,1,0]=4 1255 B18R3.3958 Sc1ccccc1c2ccc3cnoc3c2 82e6858e265bce36f67bf10ed6b8f001 [0,1,0,1,0,0|2,0,0]=4 1256 B18R3.3958 Sc1ccccc1c2ccc3ncoc3c2 148dc319058fb979e257f6144752698d [0,1,0,1,0,0|2,0,0]=4 1257 B18R3.3958 Sc1ccccc1c2cnc3cc[nH]c3c2 c8879844107f35f3d605127b2e0620f6 [0,1,0,1,0,0|2,0,0]=4 1258 B18R3.3958 Sc1ccccc1c2cnc3ccoc3c2 732da66a79764bad4812f8bcec2f66e4 [0,1,0,1,0,0|1,0,0]=3 1259 B18R3.3958 Sc1ccccc1c2cnc3ccsc3c2 d5050bbb39334af9fe8acdea14c6225c [0,1,0,1,0,0|1,1,0]=4 1260 B18R3.3958 Sc1ccncc1c2ccc3ccoc3c2 3d39003515a80d9771e1681e279cf649 [0,1,0,1,0,0|2,0,0]=4 1261 B18R3.3958 [O-][n+]1ccccc1c2ccc3ccoc3c2 5bb77b17dd8d3b214ed88fe945cc6f8f [0,1,0,1,0,0|2,0,0]=4 1262 B18R3.3958 [O-][n+]1ccccc1c2cnc3ccoc3c2 a23c9dc769fbee3ebffa096b0961d3d2 [0,1,0,1,0,0|2,0,0]=4 1263 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 b70906f6e529d540358ebd1b0a7ded39 [1,0,0,0,0,1|2,0,0]=4 1264 B16R2.88 O=C(Nc1ccccn1)c2ccccc2 502bc8512df148a3a9e6bca9ac61e2ab [1,0,0,0,0,1|2,0,0]=4 1265 B16R2.88 O=C(Nc1cccnc1)c2ccccc2 078beee1f42d2f7475cd583e3db13155 [1,0,0,0,0,1|2,0,0]=4 1266 B16R2.88 O=C(Nc1cccnn1)c2ccccc2 9a2e9390983c61b5dbda3a63ded12841 [1,0,0,0,0,1|2,0,0]=4 1267 B16R2.88 O=C(Nc1ccncc1)c2ccccc2 d576aaae6774e98bd1d63f28669e2547 [1,0,0,0,0,1|2,0,0]=4 1268 B16R2.88 O=C(Nc1ccncn1)c2ccccc2 fde101ba5233122a12f2c11c845c1b0f [1,0,0,0,0,1|2,0,0]=4 1269 B16R2.88 O=C(Nc1cnccn1)c2ccccc2 5d01810f8d4fea2ce52beafd13cd5d70 [1,0,0,0,0,1|2,0,0]=4 1270 B16R2.524 O=C(Cc1ccco1)Nc2ccccn2 bd7a68f1753ef3614aeb17b273b40677 [1,0,0,0,0,1|1,0,1]=4 1271 B16R2.524 O=C(Cc1ccco1)Nc2cccnc2 108c9848ba77ef6a85473af0db4d86b8 [1,0,0,0,0,1|1,0,1]=4 1272 B16R2.524 O=C(Cc1ccno1)Nc2ccccc2 7c421fdf010d1f9b967ee52ae0c43352 [1,0,0,0,0,1|1,0,1]=4 1273 B16R2.5767 C=C(CNc1cccs1)c2ccccc2 d5dcb82682942662ffc3f58799b84f85 [1,0,0,0,0,1|0,1,1]=4 1274 B16R2.5767 C=C(CNc1ccno1)c2ccccc2 e2c5d75f8cbc345fd66d487b0d487771 [1,0,0,0,0,1|1,0,1]=4 1275 B16R2.5767 C=C(COc1ccco1)c2ccccc2 dbd2aa2c5512b47a918ba61a6d12326f [1,0,0,0,0,1|0,0,1]=3 1276 B16R2.5767 C=C(COc1cccs1)c2ccccc2 4bac6daf8a94594f4c4aa5f03b8f55a2 [1,0,0,0,0,1|0,1,1]=4 1277 B16R2.5767 O=C(CNc1ccco1)c2ccccc2 ed53239edfdcdfa64b4278d52063879d [1,0,0,0,0,1|0,0,1]=3 1278 B16R2.5767 O=C(CNc1cccs1)c2ccccc2 d9a5f6bd74d0255d2877496876f4c06b [1,0,0,0,0,1|0,1,1]=4 1279 B16R2.5767 O=C(CNc1ccno1)c2ccccc2 c9f451cc5bf96b1c51e2f073507f674d [1,0,0,0,0,1|1,0,1]=4 1280 B16R2.5767 O=C(CNc1cnco1)c2ccccc2 d8306e54f39daf4dffd3eb92f51df54f [1,0,0,0,0,1|1,0,1]=4 1281 B16R2.5767 O=C(CNc1ncco1)c2ccccc2 8d0b444f8a6f3c4cf7e453a9aca1972e [1,0,0,0,0,1|1,0,1]=4 1282 B16R2.5767 O=C(COc1ccco1)c2ccccc2 6d1b86bf8d9bdeb1a5c734e404a4e075 [1,0,0,0,0,1|0,0,1]=3 1283 B16R2.5767 O=C(COc1ccco1)c2ccccn2 17313faf15dea2b9e4fb2f5174a347be [1,0,0,0,0,1|1,0,1]=4 1284 B16R2.5767 O=C(COc1ccco1)c2cccnc2 3e268eb8345fd7175648f04ca3e7b444 [1,0,0,0,0,1|1,0,1]=4 1285 B16R2.5767 O=C(COc1cccs1)c2ccccc2 a8379e7d376cc5db2c84d5aef7df01c6 [1,0,0,0,0,1|0,1,1]=4 1286 B16R2.5767 O=C(NCc1ccco1)c2ccccc2 3da657904295e4932fb24a5386e1c43e [1,0,0,0,0,1|0,0,1]=3 1287 B16R2.5767 O=C(NCc1ccco1)c2ccccn2 74ff003a2d0911b87a2a662a372cbf6f [1,0,0,0,0,1|1,0,1]=4 1288 B16R2.5767 O=C(NCc1ccco1)c2cccnc2 40f01d6899e2662fec2d25f7ca991b85 [1,0,0,0,0,1|1,0,1]=4 1289 B16R2.5767 O=C(NCc1ccco1)c2ccncc2 1cd2ab647d41395c5bfe9655f01287c8 [1,0,0,0,0,1|1,0,1]=4 1290 B16R2.5767 O=C(NCc1cccs1)c2ccccc2 2107716034291cdc3ac8289021956f98 [1,0,0,0,0,1|0,1,1]=4 1291 B16R2.5767 O=C(NCc1ccno1)c2ccccc2 ab80b1e9cdc3256865f46d960e932ef3 [1,0,0,0,0,1|1,0,1]=4 1292 B16R2.5767 O=C(NCc1cnco1)c2ccccc2 b9d566866e183d41faa93427213f82e6 [1,0,0,0,0,1|1,0,1]=4 1293 B16R2.5767 O=C(NCc1ncco1)c2ccccc2 43f9fda28b0ac59dea6a1c9c9c05dc0e [1,0,0,0,0,1|1,0,1]=4 1294 B16R2.5767 O=S(COc1ccco1)c2ccccc2 7c0536ef6af30db3ca598de67eff1747 [1,0,0,0,0,1|1,0,1]=4 1295 B18R2.28255 O=CC(Cc1ccccc1)NCc2ccco2 4954abf9786384ffcda277259a2630db [0,0,0,0,0,2|0,0,2]=4 1296 B18R2.126862 N#CC(=COCc1ccco1)c2ccccc2 f5bb035ea0f2ef36b7f6dbd912f09146 [0,0,0,0,0,2|1,0,1]=4 1297 B18R2.126862 O=C/C(=C\OCc1ccco1)/c2ccccc2 9316a9611653e531e48b8b8e70ce9bce [0,0,0,0,0,2|0,0,0]=2 1298 B18R2.126862 O=C/C(=C\OCc1ccco1)/c2ccccn2 aa6f9d4caa463c3f285891a2e1a236cf [0,0,0,0,0,2|1,0,0]=3 1299 B18R2.126862 O=C/C(=C\OCc1ccco1)/c2ccncc2 f74faa8ca086663a1a55aacd254f8f6b [0,0,0,0,0,2|1,0,0]=3 1300 B18R2.126862 O=C/C(=C\OCc1ccco1)/c2ccncn2 2eaf59bd8af72aa5a7995df6ef0e522b [0,0,0,0,0,2|2,0,0]=4 1301 B18R2.126862 O=C/C(=C\OCc1ccco1)/c2cnccn2 0a244b3b2a679ce0b09a572faf37893d [0,0,0,0,0,2|2,0,0]=4 1302 B18R2.126862 O=C/C(=C\OCc1cccs1)/c2ccccc2 4786044cd7ecc03bd64b73a12fbeb956 [0,0,0,0,0,2|0,1,0]=3 1303 B18R2.126862 O=C/C(=C\OCc1cccs1)/c2ccccn2 5db1b708f932536bf641583d15477c03 [0,0,0,0,0,2|1,1,0]=4 1304 B18R2.126862 O=C/C(=C\OCc1cccs1)/c2ccncc2 91570a046cc1c18d2680794474c841b8 [0,0,0,0,0,2|1,1,0]=4 1305 B18R2.126862 O=C/C(=C\OCc1ccno1)/c2ccccc2 83783b11cf017bbdb81ad0f0bcee93ae [0,0,0,0,0,2|1,0,0]=3 1306 B18R2.126862 O=C/C(=C\OCc1ccno1)/c2ccccn2 b39758f8e64391fe0680a56908d3ff91 [0,0,0,0,0,2|2,0,0]=4 1307 B18R2.126862 O=C/C(=C\OCc1ccno1)/c2ccncc2 0b0931c61933dc61343f8ea37553d814 [0,0,0,0,0,2|2,0,0]=4 1308 B18R2.126862 O=C/C(=C\OCc1ccon1)/c2ccccc2 8c42832f9b477f8e1c1ca9a07c270536 [0,0,0,0,0,2|2,0,0]=4 1309 B18R2.126862 O=C/C(=C\OCc1ccsc1)/c2ccccc2 2fda27cbf59c4621f53d13b23af034cb [0,0,0,0,0,2|2,0,0]=4 1310 B18R2.126862 O=C/C(=C\OCc1cnc[nH]1)/c2ccccc2 53529133cd7fe47e7761c9ec43db2a27 [0,0,0,0,0,2|2,0,0]=4 1311 B18R2.126862 O=C/C(=C\OCc1cnco1)/c2ccccc2 569584f5bd88efeba685292623d4a355 [0,0,0,0,0,2|1,0,0]=3 1312 B18R2.126862 O=C/C(=C\OCc1cnco1)/c2ccccn2 5e8b408e74ad60332b5a5648c7a552a1 [0,0,0,0,0,2|2,0,0]=4 1313 B18R2.126862 O=C/C(=C\OCc1cnco1)/c2ccncc2 98201a45d3fd077b9257266dd9ba5c5e [0,0,0,0,0,2|2,0,0]=4 1314 B18R2.126862 O=C/C(=C\OCc1cocn1)/c2ccccc2 0e8320ec541173098ffe02c254c8caad [0,0,0,0,0,2|2,0,0]=4 1315 B18R2.126862 O=C/C(=C\OCc1cscn1)/c2ccccc2 97cb09c35fd2c6e7f0899440ea15faaa [0,0,0,0,0,2|2,0,0]=4 1316 B18R2.126862 O=C/C(=C\OCc1ncc[nH]1)/c2ccccc2 12a20a94fa4fa78ffafe0b58600cac31 [0,0,0,0,0,2|2,0,0]=4 1317 B18R2.126862 O=C/C(=C\OCc1ncco1)/c2ccccc2 7c363c4e36680d5e2d912a48169c9b82 [0,0,0,0,0,2|1,0,0]=3 1318 B18R2.126862 O=C/C(=C\OCc1ncco1)/c2ccccn2 7e91f7257c06963067c18935b3e19660 [0,0,0,0,0,2|2,0,0]=4 1319 B18R2.126862 O=C/C(=C\OCc1ncco1)/c2ccncc2 ea9435fc19856c447e7db437b8670c96 [0,0,0,0,0,2|2,0,0]=4 1320 B18R2.126862 O=C/C(=C\OCc1nccs1)/c2ccccc2 f7c78ad78caf84650809ce8668dc82f6 [0,0,0,0,0,2|1,1,0]=4 1321 B18R2.126862 O=C/C(=C\OCc1ncno1)/c2ccccc2 028415ba77e967450e0825b00fc5c50f [0,0,0,0,0,2|2,0,0]=4 1322 B18R2.126862 O=C/C(=C\OCc1nnco1)/c2ccccc2 61d446ca373dbdeedc5f222db98e66a7 [0,0,0,0,0,2|2,0,0]=4 1323 B18R2.126862 O=CC(NCCc1ccco1)c2ccccc2 e011a0a1a185c803f235fd2176675d76 [0,0,0,0,0,2|0,0,2]=4