0 B22R2.8946400 CC(=O)c1cc(no1)c2ccc(c(c2)C#N)OCC(C)C 37bd6fec68120b7d726500ccf2616d61 [1,0,0,0,0,0|3,0,0]=4 1 B22R2.8946400 CC(=O)c1cnc(s1)c2ccc(c(c2)C#N)OCC(C)C c8c608cc5b2e9d4864c8287b52f51310 [1,0,0,0,0,0|3,0,0]=4 2 B22R2.8946400 CC(=O)c1csc(c1)c2ccc(c(c2)C#N)OCC(C)C 4f2c0d14e7fc0f8ce2c2779af7360676 [1,0,0,0,0,0|3,0,0]=4 3 B22R2.8946400 CC(=O)n1cnc(c1)c2ccc(c(c2)C#N)OCC(C)C f5ecc5bbb8ff66a1f9404077bf23ac65 [1,0,0,0,0,0|3,0,0]=4 4 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2c[nH]c(c2)C(=O)O 955a87b84f0ae54bc3bff7e64d7374a1 [1,0,0,0,0,0|3,0,0]=4 5 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(co2)C(=O)N 8a4c4bf8e0f75b58c0e96fe38d1baa42 [1,0,0,0,0,0|3,0,0]=4 6 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(co2)C(=O)O d563b0db943fde0c9cf9536d49663137 [1,0,0,0,0,0|2,0,0]=3 7 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(cs2)C(=O)N d991f90c0b562fbd4c7c440836b2f6fe [1,0,0,0,0,0|3,0,0]=4 8 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(cs2)C(=O)O 3543eb41e34fcb22381927c4361ec9ba [1,0,0,0,0,0|2,0,0]=3 9 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(n[nH]2)C(=O)O 67d9a3a7fd81b4a2afc7a7231d72b30f [1,0,0,0,0,0|2,0,1]=4 10 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(no2)C(=O)O ea9aaef49b784a3e9e712a4cf94ff960 [1,0,0,0,0,0|3,0,0]=4 11 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(ns2)C(=O)O 75340295f55e1c77d7add8fcaa6b1078 [1,0,0,0,0,0|3,0,0]=4 12 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(on2)C(=O)N 45cdcbbdda7842c7dde48ff20d771090 [1,0,0,0,0,0|3,0,0]=4 13 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(on2)C(=O)O fbd2510d294f780db25e03674e689e31 [1,0,0,0,0,0|2,0,0]=3 14 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(sn2)C(=O)N 523d03bd6ccb3711aa71752eb0b9b1ac [1,0,0,0,0,0|3,0,0]=4 15 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2cc(sn2)C(=O)O 8bdbd5a6abb717ae36cab5424abb3f66 [1,0,0,0,0,0|2,0,0]=3 16 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ccc([nH]2)C(=O)O 39d3eec2ce12bd88e4fdabcd23452597 [1,0,0,0,0,0|3,0,0]=4 17 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ccc(o2)C(=O)O 06566ab756271d7a46b09ab855243b3b [1,0,0,0,0,0|3,0,0]=4 18 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ccc(s2)C(=O)O 0ac0c119ddc5b3e6f6b25494c9e16bfa [1,0,0,0,0,0|3,0,0]=4 19 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2coc(c2)C(=O)O dd0563e834111673af83b30ebbc00824 [1,0,0,0,0,0|3,0,0]=4 20 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2csc(c2)C(=O)O 88280f1a1b814c05cb60d4ebb4b2b8f4 [1,0,0,0,0,0|3,0,0]=4 21 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(co2)C(=O)O 95892c0c95f9f21f2060afe6a2664219 [1,0,0,0,0,0|3,0,0]=4 22 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nc(cs2)C(=O)O 6039188a500e5169cd5f13035b2cdf57 [1,0,0,0,0,0|3,0,0]=4 23 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc([nH]2)C(=O)O ae0ed5c81af2da7b463665a36907c209 [1,0,0,0,0,0|2,0,0]=3 24 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(o2)C(=O)N 53fd34e6357427fa38d9c8339c7511fa [1,0,0,0,0,0|3,0,0]=4 25 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(o2)C(=O)O 4f06c6a03eee034625a890f020a2479e [1,0,0,0,0,0|2,0,0]=3 26 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(s2)C(=O)N c2461b2b7f9d8802f154791c15e816d7 [1,0,0,0,0,0|3,0,0]=4 27 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2ncc(s2)C(=O)O b2efcf07f1db2d2d2066189e81fccaf3 [1,0,0,0,0,0|2,0,0]=3 28 B22R2.8946400 CC(C)COc1ccc(cc1C#N)c2nnc(s2)C(=O)O f2fdaf89fbae44182aa0806b36f63c93 [1,0,0,0,0,0|3,0,0]=4 29 B22R2.8946452 CC(=O)c1cc(no1)c2ccc(c(c2)C#N)OC(C)(C)C 753b33fb4bfbfec222b3677a473d3e6c [0,0,0,0,1,0|3,0,0]=4 30 B22R2.8946452 CC(=O)c1cnc(s1)c2ccc(c(c2)C#N)OC(C)(C)C 037aea40b6108b3d9a66843be81297e1 [0,0,0,0,1,0|3,0,0]=4 31 B22R2.8946452 CC(=O)c1csc(c1)c2ccc(c(c2)C#N)OC(C)(C)C f8a09869fd882e9354d141aa51c931dc [0,0,0,0,1,0|3,0,0]=4 32 B22R2.8946452 CC(=O)n1cnc(c1)c2ccc(c(c2)C#N)OC(C)(C)C ec8584a95904895993b86d8d982404b1 [0,0,0,0,1,0|3,0,0]=4 33 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2c[nH]c(c2)C(=O)O 2a9f8490687b19a3dc1816351d1f7a76 [0,0,0,0,1,0|3,0,0]=4 34 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(c[nH]2)C(=O)O b02fda7e961746b08339c3cc857c05b9 [0,0,0,0,1,0|1,0,1]=3 35 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(co2)C(=O)N c7408f107fbc568c55a9e972b1bf103c [0,0,0,0,1,0|3,0,0]=4 36 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(co2)C(=O)O a3fdbea8f6e418efce26157208eaf482 [0,0,0,0,1,0|2,0,0]=3 37 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(cs2)C(=O)N 13f99a2cba85349f876b37c1157fb846 [0,0,0,0,1,0|3,0,0]=4 38 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(cs2)C(=O)O 70f3a8f2b19d071b6a2ed055d3993e2c [0,0,0,0,1,0|2,0,0]=3 39 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(n[nH]2)C(=O)O d360894e7cd549bbedd3e4b8a3e56c5a [0,0,0,0,1,0|2,0,1]=4 40 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(no2)C(=O)O 1989bb177fc1167fa0bd71d5b772a9de [0,0,0,0,1,0|3,0,0]=4 41 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(ns2)C(=O)O 6080ff424b46475cc4ee9fda70cdebb1 [0,0,0,0,1,0|3,0,0]=4 42 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(on2)C(=O)N 6d1451eb8b301f9b3aabbe5cc351eb89 [0,0,0,0,1,0|3,0,0]=4 43 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(on2)C(=O)O 0b4a5fb658877cb3913b6de229576554 [0,0,0,0,1,0|2,0,0]=3 44 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(sn2)C(=O)N bd884051259652cdb3af6c47313fcb7d [0,0,0,0,1,0|3,0,0]=4 45 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2cc(sn2)C(=O)O c31d480bd29f489dd884547341ee19e7 [0,0,0,0,1,0|2,0,0]=3 46 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ccc([nH]2)C(=O)O 655eeda795fecb9fb5d7289ed54fd64d [0,0,0,0,1,0|3,0,0]=4 47 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(o2)C(=O)O fc01801ce73833794c2ef439c2a93fe8 [0,0,0,0,1,0|3,0,0]=4 48 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(s2)C(=O)O c1309365330e24116101dfff924fcc37 [0,0,0,0,1,0|3,0,0]=4 49 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2coc(c2)C(=O)O 6d41c2dce1863bcb765b64c1f82c40a6 [0,0,0,0,1,0|3,0,0]=4 50 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2csc(c2)C(=O)O aa11c354f38075339dc8d480e3f7f554 [0,0,0,0,1,0|3,0,0]=4 51 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2nc(co2)C(=O)O 1b26a65f7944604ab73d7cf9acfaeb0e [0,0,0,0,1,0|3,0,0]=4 52 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2nc(cs2)C(=O)O 5a060cb39ca316ed61e7d1029b27ff7c [0,0,0,0,1,0|3,0,0]=4 53 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ncc([nH]2)C(=O)O a7d171dd7b1b2d192efad5ab267c292b [0,0,0,0,1,0|2,0,0]=3 54 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(o2)C(=O)N 3b83d7119cf390716013ca3c2ac09697 [0,0,0,0,1,0|3,0,0]=4 55 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(o2)C(=O)O dcb4fe02f0256fd12f717f6e8d04b235 [0,0,0,0,1,0|2,0,0]=3 56 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(s2)C(=O)N db6cd0c9466aaad3b1f5dbd301a9cfbc [0,0,0,0,1,0|3,0,0]=4 57 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(s2)C(=O)O c3619ef3bc560415e7564784f5e3bcef [0,0,0,0,1,0|2,0,0]=3 58 B22R2.8946452 CC(C)(C)Oc1ccc(cc1C#N)c2nnc(s2)C(=O)O fd5e9322e3a66305c8a2483a728bad21 [0,0,0,0,1,0|3,0,0]=4 59 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2cc(c[nH]2)C(=O)O 656bb34ed6028837dabab5f06c0a6418 [0,0,0,0,1,0|2,0,1]=4 60 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2cc(co2)C(=O)O e27ad66b2708d0f01f05820a63c0e172 [0,0,0,0,1,0|3,0,0]=4 61 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2cc(cs2)C(=O)O 6ee58f3f4e65c13879b6dabdfff0aef5 [0,0,0,0,1,0|3,0,0]=4 62 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2cc(on2)C(=O)O 8c4dc4ede0cc232f74ec5f70328a566d [0,0,0,0,1,0|3,0,0]=4 63 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2cc(sn2)C(=O)O 72e7a0b40d303b8b4cbca8b394185138 [0,0,0,0,1,0|3,0,0]=4 64 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2ncc([nH]2)C(=O)O 8518ed2b89275f10e0299933f4e6be4a [0,0,0,0,1,0|3,0,0]=4 65 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2ncc(o2)C(=O)O d06b1837a53f8872cbd8aa703215c886 [0,0,0,0,1,0|3,0,0]=4 66 B22R2.8946452 CC(C)(C)Oc1ncc(cc1C#N)c2ncc(s2)C(=O)O 60d1b2099eb217be2215f359831554f4 [0,0,0,0,1,0|3,0,0]=4 67 B22R2.8946452 N#Cc1cc(ccc1OC(F)(F)F)n2cc(cn2)C(=O)O a86a73104449fd7525f2524abe80a66f [0,0,0,0,1,0|3,0,0]=4 68 B21R2.45502 CC(C)COc1ccc(cc1C#N)c2cc(c[nH]2)C=O 2364788de00052ff37a90c52e6c431ac [2,0,0,0,0,0|1,0,1]=4 69 B21R2.45502 CC(C)COc1ccc(cc1C#N)c2cc(co2)C=O 5028b5560ef5da182a0251a05bafce4b [2,0,0,0,0,0|2,0,0]=4 70 B21R2.45502 CC(C)COc1ccc(cc1C#N)c2cc(cs2)C=O e76bd8bce6f21f8f6e67f28c2c827549 [2,0,0,0,0,0|2,0,0]=4 71 B21R2.45502 CC(C)COc1ccc(cc1C#N)c2cc(on2)C=O 921875ba8e891cb9e3d62b3391ada66d [2,0,0,0,0,0|2,0,0]=4 72 B21R2.45502 CC(C)COc1ccc(cc1C#N)c2ncc([nH]2)C=O 887f37c6d60d7f609dc6eb2c1b2baacf [2,0,0,0,0,0|2,0,0]=4 73 B21R2.45502 CC(C)COc1ccc(cc1C#N)c2ncc(s2)C=O 303536c3f829c20639a07bc0f5d9fd10 [2,0,0,0,0,0|2,0,0]=4 74 B21R2.253597 CC(=O)c1cnn(c1)c2ccc(cc2)NCC(C)(C)C 3597140cfe8fc853d1a08b0fa4ce2a81 [2,0,0,0,0,0|2,0,0]=4 75 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2cc(co2)C(=O)O 89d4dafe5a529d911ae59b767bb66e58 [2,0,0,0,0,0|2,0,0]=4 76 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2cc(cs2)C(=O)O 37fee00d99e71f8af8925059ce95b6e9 [2,0,0,0,0,0|2,0,0]=4 77 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2cc(on2)C(=O)O 945573620e6671d23a45d04720965f66 [2,0,0,0,0,0|2,0,0]=4 78 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2cc(sn2)C(=O)O b871736f9ce6b1083ba7bba34bd68b8f [2,0,0,0,0,0|2,0,0]=4 79 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2ncc([nH]2)C(=O)O 7df9711f24e439af7e5e4b2a4b6ab3f1 [2,0,0,0,0,0|2,0,0]=4 80 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2ncc(o2)C(=O)O 54cc397de4bb234e7245d7177cdb623f [2,0,0,0,0,0|2,0,0]=4 81 B21R2.253597 CC(C)(C)COc1ccc(cc1)c2ncc(s2)C(=O)O 7fa3780c427bdf017e5ed641c220ca1e [2,0,0,0,0,0|2,0,0]=4 82 B21R2.50016 CCCOc1ccc(cc1C#N)c2cc(c[nH]2)C(=O)O d774299943ca5287ead4cad00fcdf733 [2,0,0,0,0,0|1,0,1]=4 83 B21R2.50016 CCCOc1ccc(cc1C#N)c2cc(co2)C(=O)O ed555951f1696cd44051ac67d2503277 [2,0,0,0,0,0|2,0,0]=4 84 B21R2.50016 CCCOc1ccc(cc1C#N)c2cc(cs2)C(=O)O 683e574b2182e547067008b886e8081a [2,0,0,0,0,0|2,0,0]=4 85 B21R2.50016 CCCOc1ccc(cc1C#N)c2cc(on2)C(=O)O 406e7ea3ae3c19396a2a2445614db153 [2,0,0,0,0,0|2,0,0]=4 86 B21R2.50016 CCCOc1ccc(cc1C#N)c2cc(sn2)C(=O)O 815cfd1b6ef4acb512c882058997b0e1 [2,0,0,0,0,0|2,0,0]=4 87 B21R2.50016 CCCOc1ccc(cc1C#N)c2ncc([nH]2)C(=O)O b01ac2fa3325b3e9d133672124d9403a [2,0,0,0,0,0|2,0,0]=4 88 B21R2.50016 CCCOc1ccc(cc1C#N)c2ncc(o2)C(=O)O c20422c9c325083138452fae193df4a7 [2,0,0,0,0,0|2,0,0]=4 89 B21R2.50016 CCCOc1ccc(cc1C#N)c2ncc(s2)C(=O)O a681af56915308e36ce7e1a967aea1ab [2,0,0,0,0,0|2,0,0]=4 90 B21R2.50016 CCCOc1ccc(cc1CO)n2cc(cn2)C(=O)O 50d73b97a9a0a8f91a44b53d1c82caa0 [2,0,0,0,0,0|1,0,1]=4 91 B21R2.50016 COCOc1ccc(cc1C#N)n2cc(cn2)C(=O)C 19e2f8fb724e502ac4bbbbd6fcbf6e08 [2,0,0,0,0,0|2,0,0]=4 92 B21R2.50016 COCOc1ccc(cc1C#N)n2cc(cn2)C(=O)N 5bfcddce79526481406dcef9cdd614aa [2,0,0,0,0,0|2,0,0]=4 93 B21R2.50016 COCOc1ccc(cc1C#N)n2cc(cn2)C(=O)O 885fa3655efd70f9b60f5cfa5ef5c7aa [2,0,0,0,0,0|1,0,0]=3 94 B23R2.12954910 CC(C)COc1ccc(cc1C#N)c2cc(n(n2)C)C(=O)O 274c0d98b4f047cf08547d146cc2d54f [1,1,0,0,0,0|2,0,0]=4 95 B23R2.12954910 Cc1nc(oc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C 5d60928fa9858cbde452649b8d3af5c3 [1,1,0,0,0,0|2,0,0]=4 96 B23R2.12954910 Cc1nc(sc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C fa9090cec49ca85ab77354852785b13a [1,1,0,0,0,0|2,0,0]=4 97 B23R2.12954910 Cc1oc(cc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C 496a7b2b2836d9fdab0b30589b8e44b3 [1,1,0,0,0,0|2,0,0]=4 98 B23R2.12954910 Cc1sc(cc1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C b0c4eed6b7efa554a6599f8f9304d75a [1,1,0,0,0,0|2,0,0]=4 99 B23R2.12954915 COC(=O)c1c[nH]c(c1)c2ccc(c(c2)C#N)OCC(C)C 5aa47129c22d10d5ab79abfe9fab30ef [1,1,0,0,0,0|1,0,1]=4 100 B23R2.12954915 COC(=O)c1cc(no1)c2ccc(c(c2)C#N)OCC(C)C 9363918b061b30ff861ab24071b49ee2 [1,1,0,0,0,0|2,0,0]=4 101 B23R2.12954915 COC(=O)c1cc(ns1)c2ccc(c(c2)C#N)OCC(C)C d5759527d1bcad06c0a1661edac7f25c [1,1,0,0,0,0|2,0,0]=4 102 B23R2.12954915 COC(=O)c1cnc([nH]1)c2ccc(c(c2)C#N)OCC(C)C a1e228e2cb157860ff666e25f81113ce [1,1,0,0,0,0|2,0,0]=4 103 B23R2.12954915 COC(=O)c1cnc(o1)c2ccc(c(c2)C#N)OCC(C)C 721825b8d545181401b3db0856636524 [1,1,0,0,0,0|2,0,0]=4 104 B23R2.12954915 COC(=O)c1cnc(s1)c2ccc(c(c2)C#N)OCC(C)C 8f1303ec10c362e3bc529357d272e85e [1,1,0,0,0,0|2,0,0]=4 105 B23R2.12954915 COC(=O)c1coc(c1)c2ccc(c(c2)C#N)OCC(C)C 24845cfbb1c1119bbea13113038c434d [1,1,0,0,0,0|2,0,0]=4 106 B23R2.12954915 COC(=O)c1csc(c1)c2ccc(c(c2)C#N)OCC(C)C 35bd74e1b6ffc0ca08ca9a951df2ef62 [1,1,0,0,0,0|2,0,0]=4 107 B23R2.12954918 CC(C)COc1ccc(cc1C#N)c2cc(cn2C)C(=O)O 11f50ecc96ad6ee188cc098f47b5b2c2 [1,1,0,0,0,0|1,0,1]=4 108 B23R2.20039052 CC(C)COc1ccc(cc1C#N)c2ncc(n2C)C(=O)O ae66feccebee3422e8cd6a826b0a87b0 [1,1,0,0,0,0|2,0,0]=4 109 B23R2.20039052 Cc1c(csc1c2ccc(c(c2)C#N)OCC(C)C)C(=O)O 500c086c71b81c17b378dc83b625e7b3 [1,1,0,0,0,0|2,0,0]=4 110 B23R2.20039052 Cc1c(n[nH]c1C(=O)O)c2ccc(c(c2)C#N)OCC(C)C b0a7486c679b48b278413292d5ad8b04 [1,1,0,0,0,0|2,0,0]=4 111 B23R2.12954997 Cc1nc(oc1C(=O)O)c2ccc(c(c2)C#N)OC(C)(C)C 0d0bbd4ac70621b69dd1fc656a4a3285 [0,1,0,0,1,0|2,0,0]=4 112 B23R2.12954997 Cc1nc(sc1C(=O)O)c2ccc(c(c2)C#N)OC(C)(C)C aea2e72e8b0366c8875eebeb7fc50998 [0,1,0,0,1,0|2,0,0]=4 113 B23R2.12954997 Cc1oc(cc1C(=O)O)c2ccc(c(c2)C#N)OC(C)(C)C 361ae324bc0395536b79be18c642b166 [0,1,0,0,1,0|2,0,0]=4 114 B23R2.12954997 Cc1sc(cc1C(=O)O)c2ccc(c(c2)C#N)OC(C)(C)C a934cdc965a9bb256534269aa7ffd98f [0,1,0,0,1,0|2,0,0]=4 115 B23R2.12954997 Cn1nc(cc1C(=O)O)c2ccc(c(c2)C#N)OC(C)(C)C d61e59884873770569a0ddd2bb917fa2 [0,1,0,0,1,0|2,0,0]=4 116 B23R2.12955002 COC(=O)c1c[nH]c(c1)c2ccc(c(c2)C#N)OC(C)(C)C 4d52343dde2ac445b3bb67a50149a5ea [0,1,0,0,1,0|1,0,1]=4 117 B23R2.12955002 COC(=O)c1cc(no1)c2ccc(c(c2)C#N)OC(C)(C)C 94f72b6e3e37b036fa77f861c6334f6b [0,1,0,0,1,0|2,0,0]=4 118 B23R2.12955002 COC(=O)c1cc(ns1)c2ccc(c(c2)C#N)OC(C)(C)C c4c22d90db2acd1ee07623eb44651837 [0,1,0,0,1,0|2,0,0]=4 119 B23R2.12955002 COC(=O)c1cnc([nH]1)c2ccc(c(c2)C#N)OC(C)(C)C cd3735f6369b2ed423731414e95a93bc [0,1,0,0,1,0|2,0,0]=4 120 B23R2.12955002 COC(=O)c1cnc(o1)c2ccc(c(c2)C#N)OC(C)(C)C 215ae7c129292be5a46e42066200802f [0,1,0,0,1,0|2,0,0]=4 121 B23R2.12955002 COC(=O)c1cnc(s1)c2ccc(c(c2)C#N)OC(C)(C)C dd983c963524fc8ea35fa94b0f5e365d [0,1,0,0,1,0|2,0,0]=4 122 B23R2.12955002 COC(=O)c1coc(c1)c2ccc(c(c2)C#N)OC(C)(C)C c68c0c3708c444712306b24d6e082011 [0,1,0,0,1,0|2,0,0]=4 123 B23R2.12955002 COC(=O)c1csc(c1)c2ccc(c(c2)C#N)OC(C)(C)C 276b2572b22d4841030de4e07934c762 [0,1,0,0,1,0|2,0,0]=4 124 B23R2.12955005 Cn1cc(cc1c2ccc(c(c2)C#N)OC(C)(C)C)C(=O)O f630494432f65e6ca1e9c47d7f44c594 [0,1,0,0,1,0|1,0,1]=4 125 B23R2.20073761 CC(C)(C)Oc1ccc(cc1C#N)c2n[nH]c(c2N)C(=O)O 12f75feee336bb7bef8927c8edbd0959 [0,1,0,0,1,0|2,0,0]=4 126 B23R2.20073761 Cc1c(csc1c2ccc(c(c2)C#N)OC(C)(C)C)C(=O)O b5e0952f186cf3f7eb760af355a5d99f [0,1,0,0,1,0|2,0,0]=4 127 B23R2.20073761 Cc1c(n[nH]c1C(=O)O)c2ccc(c(c2)C#N)OC(C)(C)C 6539860c6cf7041f646e411e11a8083e [0,1,0,0,1,0|2,0,0]=4 128 B23R2.20073761 Cn1c(cnc1c2ccc(c(c2)C#N)OC(C)(C)C)C(=O)O f9feb58fb8e3af3cecef79e7b667fa62 [0,1,0,0,1,0|2,0,0]=4 129 B25R2.20302522 CC(C)(C)COc1ccc(cc1C#N)n2cc(cn2)C(=O)NC#N cfb2f64e0127b475e2352cd5c6fd9890 [0,2,0,0,0,0|1,0,0]=3 130 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3cc(co3)C(=O)O cd7a2487fa99048577a3f86b7b471bf6 [1,0,0,1,0,0|2,0,0]=4 131 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3cc(cs3)C(=O)O 61887f0d6cbadbc5247e5af1feebd3a7 [1,0,0,1,0,0|2,0,0]=4 132 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3cc(on3)C(=O)O a32c97f75fcf10afb4ac1462471c7c96 [1,0,0,1,0,0|2,0,0]=4 133 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3cc(sn3)C(=O)O 0e658dca4745e04c21053169007e5618 [1,0,0,1,0,0|2,0,0]=4 134 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3ncc([nH]3)C(=O)O d5332c3d9c86523f9a86c8e4434f017d [1,0,0,1,0,0|2,0,0]=4 135 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3ncc(o3)C(=O)O e57bb2e1d887aada1f13e7494b8d24c5 [1,0,0,1,0,0|2,0,0]=4 136 B23R3.1999715 N#Cc1cc(ccc1OCC2CC2)c3ncc(s3)C(=O)O 16e464f76917e600db8cd2da1b49feea [1,0,0,1,0,0|2,0,0]=4 137 B21R2.45499 CC(C)(C)Oc1ccc(cc1C#N)c2cc(c[nH]2)C=O 7b41539c0f4980f2f5d6e900cb74be8b [1,0,0,0,1,0|1,0,1]=4 138 B21R2.45499 CC(C)(C)Oc1ccc(cc1C#N)c2cc(cs2)C=O f33dee7f5e3d65af9caa350a9ad53c51 [1,0,0,0,1,0|2,0,0]=4 139 B21R2.45499 CC(C)(C)Oc1ccc(cc1C#N)c2cc(on2)C=O c546ec761d0a8ba87be1174f5ae86d8d [1,0,0,0,1,0|2,0,0]=4 140 B21R2.45499 CC(C)(C)Oc1ccc(cc1C#N)c2ncc([nH]2)C=O ccb02afeea23d2f5ec5ce10040df2c44 [1,0,0,0,1,0|2,0,0]=4 141 B21R2.45499 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(s2)C=O 7bf6e3c906fedfa4e8b6dea823882ef4 [1,0,0,0,1,0|2,0,0]=4 142 B21R2.42498 CC(=O)c1ccn(c1)c2ccc(c(c2)C#N)OC(C)C f9412e4a5429ea435475cf17b74afeb0 [1,0,0,0,1,0|2,0,0]=4 143 B21R2.42498 CC(=O)c1cnn(c1)c2ccc(c(c2)C#N)OC(C)C 1b0c7abcfa1db044ef066080ceaa4920 [1,0,0,0,1,0|1,0,0]=3 144 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2cc(c[nH]2)C(=O)O b61005423e557327d18494f9a675a9ba [1,0,0,0,1,0|1,0,1]=4 145 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2cc(co2)C(=O)O 2da439eac73b39b5ef362ba2283aef3b [1,0,0,0,1,0|2,0,0]=4 146 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2cc(cs2)C(=O)O fc2cafbc48cf24714b3937c1aba2bf3d [1,0,0,0,1,0|2,0,0]=4 147 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2cc(on2)C(=O)O afa287fa030f985449889008477aef4f [1,0,0,0,1,0|2,0,0]=4 148 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2cc(sn2)C(=O)O 74523f0959b76f61223841e18ae7761d [1,0,0,0,1,0|2,0,0]=4 149 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2ncc([nH]2)C(=O)O d17f24b4d6278d541fc3fbad54dd6430 [1,0,0,0,1,0|2,0,0]=4 150 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2ncc(o2)C(=O)O d7cf2e01b9fd7312a7dd0696e1900afb [1,0,0,0,1,0|2,0,0]=4 151 B21R2.42498 CC(C)Oc1ccc(cc1C#N)c2ncc(s2)C(=O)O a8c60e9f354aaf59348ef78c672f51b3 [1,0,0,0,1,0|2,0,0]=4 152 B21R2.42498 CC(C)Oc1ccc(cc1C#N)n2cc(cn2)C(=O)N 8df14dcb1755d676898d20f4cf9cea1a [1,0,0,0,1,0|1,0,0]=3 153 B21R2.42498 CC(C)Oc1ccc(cc1C#N)n2cc(cn2)C(=O)O 8c7d3a999dbd89c3c697eedaed3bcf0e [1,0,0,0,1,0|0,0,0]=2 154 B21R2.42498 CC(C)Oc1ccc(cc1C#N)n2cc(cn2)C(=S)N f2f245316db7a8c0dba807c43dfb0892 [1,0,0,0,1,0|1,1,0]=4 155 B21R2.42498 CC(C)Oc1ccc(cc1C#N)n2cc(cn2)C(C)O 3334aad9c2b5760050d6adf0da86237a [1,0,0,0,1,0|1,0,1]=4 156 B23R2.66651 CC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OCC(C)C e38b2c828fdc1b9381b314647490caeb [1,0,0,0,0,1|2,0,0]=4 157 B23R2.66651 CC(=O)c1cnc(cn1)c2ccc(c(c2)C#N)OCC(C)C 54a0254cba284a8d9203e6fb7168a99d [1,0,0,0,0,1|2,0,0]=4 158 B23R2.66651 CC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OCC(C)C 3a36d68c81fcc80bf4ad854858ebf9c7 [1,0,0,0,0,1|2,0,0]=4 159 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cc2)C(=O)O ea94fc1fdbc388b4bc99f5018663c2d3 [1,0,0,0,0,1|2,0,0]=4 160 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)N 3e966f96b3bcaf74bff957275c0d0ab2 [1,0,0,0,0,1|2,0,0]=4 161 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(cn2)C(=O)O 818f3f45607d63a00f4cd4dec3c85573 [1,0,0,0,0,1|1,0,0]=3 162 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(nc2)C(=O)O 1a18acf97ba35d651d1499e195af34f4 [1,0,0,0,0,1|2,0,0]=4 163 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ccc(nn2)C(=O)O 4ca4623fe6066de41cc115f89d83b18f [1,0,0,0,0,1|2,0,0]=4 164 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2cnc(cn2)C(=O)N f3018aa586a4cb7c07cc0d988b82e2b7 [1,0,0,0,0,1|2,0,0]=4 165 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2cnc(cn2)C(=O)O 2e23f7879214b904a5ffb844b570b164 [1,0,0,0,0,1|1,0,0]=3 166 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(=O)N d919ca4f398968f5b4adeffb48c412d2 [1,0,0,0,0,1|2,0,0]=4 167 B23R2.66651 CC(C)COc1ccc(cc1C#N)c2ncc(cn2)C(=O)O 6ebfabf29091c007ffcb012dc33360ca [1,0,0,0,0,1|1,0,0]=3 168 B23R2.12954914 CC(C)COc1ccc(cc1C#N)c2cc(on2)CC(=O)O bbdb59821b740d0061462b0b854ae473 [1,0,0,0,0,1|2,0,0]=4 169 B23R2.12954914 CC(C)COc1ccc(cc1C#N)c2ncc(s2)CC(=O)O b24faa5614bd7fdc6d1738b184f1fa9c [1,0,0,0,0,1|2,0,0]=4 170 B23R2.12954921 CC(=O)c1cc(ncn1)c2ccc(c(c2)C#N)OCC(C)C f48198e3333d58d45918a849478285fe [1,0,0,0,0,1|2,0,0]=4 171 B23R2.12954921 CC(=O)c1ccnc(c1)c2ccc(c(c2)C#N)OCC(C)C d37c53c2446ac2bd374a93fd15c208db [1,0,0,0,0,1|2,0,0]=4 172 B23R2.12954921 CC(=O)c1cncc(c1)c2ccc(c(c2)C#N)OCC(C)C 337b135600fa4d541541faf4c03661b3 [1,0,0,0,0,1|2,0,0]=4 173 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cc(ccn2)C(=O)N e07f9b1dbc73fa5ffa6ca4f5fc41f2e8 [1,0,0,0,0,1|2,0,0]=4 174 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cc(ccn2)C(=O)O 31daec89958927501fd9e5ae36d33c1e [1,0,0,0,0,1|1,0,0]=3 175 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cc(cnn2)C(=O)N c54503a6782d8838dee4dfadb00638a9 [1,0,0,0,0,1|2,0,0]=4 176 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cc(cnn2)C(=O)O 801adf95ddc43404b7b5ab7bbdb6ec38 [1,0,0,0,0,1|1,0,0]=3 177 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cc(ncn2)C(=O)N d7eb6a367bff5b18909b09eef4d43119 [1,0,0,0,0,1|2,0,0]=4 178 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cccc(c2)C(=O)O db0488ac5f55a1bb9052c9577daeef2b [1,0,0,0,0,1|2,0,0]=4 179 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2ccnc(c2)C(=O)O f21a6809cc5f5bedba51a01b6a998b4f [1,0,0,0,0,1|2,0,0]=4 180 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cncc(c2)C(=O)N 8c063f609517435a57bdfcb82b0639a3 [1,0,0,0,0,1|2,0,0]=4 181 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cncc(c2)C(=O)O 79081aa9f04bbee7f73cd1b9cc426c90 [1,0,0,0,0,1|1,0,0]=3 182 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cncc(n2)C(=O)O 65108936278728ce8383dbdf4c86cc85 [1,0,0,0,0,1|2,0,0]=4 183 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2cnnc(c2)C(=O)O dea56446b42b35c216d8800b46a97a4c [1,0,0,0,0,1|2,0,0]=4 184 B23R2.12954921 CC(C)COc1ccc(cc1C#N)c2nccc(n2)C(=O)O 0fff8bdde230fa840cd0a9a6624c9198 [1,0,0,0,0,1|2,0,0]=4 185 B23R2.67901 CC(=O)c1ccc(nc1)c2ccc(c(c2)C#N)OC(C)(C)C 4d6a6600d2d93c2476d39a1ece319776 [0,0,0,0,1,1|2,0,0]=4 186 B23R2.67901 CC(=O)c1cnc(cn1)c2ccc(c(c2)C#N)OC(C)(C)C 263f86531eade137c13d417429730d22 [0,0,0,0,1,1|2,0,0]=4 187 B23R2.67901 CC(=O)c1cnc(nc1)c2ccc(c(c2)C#N)OC(C)(C)C 2f9d7b382f3342ca6002cfc2bc74d682 [0,0,0,0,1,1|2,0,0]=4 188 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(cc2)C(=O)O 6fbaf37ee14c89d519867031476cec9e [0,0,0,0,1,1|2,0,0]=4 189 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(cn2)C(=O)N 6bb74d15be5d5aea0ba9d68ac4d82cfa [0,0,0,0,1,1|2,0,0]=4 190 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(cn2)C(=O)O 855101b2d57bd4497f1f7574ba31dea9 [0,0,0,0,1,1|1,0,0]=3 191 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(nc2)C(=O)O babb4cc83980873d35cec50d2740e72b [0,0,0,0,1,1|2,0,0]=4 192 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ccc(nn2)C(=O)O a1125643001dd34fde8cf7ff4713b0fa [0,0,0,0,1,1|2,0,0]=4 193 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2cnc(cn2)C(=O)N 81579031c156e160519f1d54f992dcd3 [0,0,0,0,1,1|2,0,0]=4 194 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2cnc(cn2)C(=O)O d44e06d944b9e81a38ebf553493275ca [0,0,0,0,1,1|1,0,0]=3 195 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(cn2)C(=O)N 0fe904e178f71c151d30314c044406eb [0,0,0,0,1,1|2,0,0]=4 196 B23R2.67901 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(cn2)C(=O)O b5aa282eb447f98addfe62a518c06144 [0,0,0,0,1,1|1,0,0]=3 197 B23R2.67901 CC(C)(C)Oc1ncc(cc1C#N)c2ccc(cn2)C(=O)O 51c7267877e7b13bbbe80c9382b4f836 [0,0,0,0,1,1|2,0,0]=4 198 B23R2.67901 CC(C)(C)Oc1ncc(cc1C#N)c2cnc(cn2)C(=O)O f48f8f6ad6eb19841d99080cd9b57da0 [0,0,0,0,1,1|2,0,0]=4 199 B23R2.67901 CC(C)(C)Oc1ncc(cc1C#N)c2ncc(cn2)C(=O)O 80b1400becc594b2ccdf5a82e3827f3d [0,0,0,0,1,1|2,0,0]=4 200 B23R2.12955001 CC(C)(C)Oc1ccc(cc1C#N)c2cc(on2)CC(=O)O b501d29400fd195daabdd40dca190b99 [0,0,0,0,1,1|2,0,0]=4 201 B23R2.12955001 CC(C)(C)Oc1ccc(cc1C#N)c2ncc(s2)CC(=O)O 8fcc09c7112740603c4a3f32fd767ab2 [0,0,0,0,1,1|2,0,0]=4 202 B23R2.12955008 CC(=O)c1cc(ncn1)c2ccc(c(c2)C#N)OC(C)(C)C 0c30b43880ab41c2a5039f9d1d5f25ad [0,0,0,0,1,1|2,0,0]=4 203 B23R2.12955008 CC(=O)c1ccnc(c1)c2ccc(c(c2)C#N)OC(C)(C)C 1dd7a1fb624fea0fb023fb600f705d72 [0,0,0,0,1,1|2,0,0]=4 204 B23R2.12955008 CC(=O)c1cncc(c1)c2ccc(c(c2)C#N)OC(C)(C)C 33aa401594d476d61676e14cb034fd45 [0,0,0,0,1,1|2,0,0]=4 205 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cc(ccn2)C(=O)N c12b50bfda62f41c8fa6b9d0e90a9384 [0,0,0,0,1,1|2,0,0]=4 206 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cc(ccn2)C(=O)O ed12b3e2f56fe961a7be2908c82428a9 [0,0,0,0,1,1|1,0,0]=3 207 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cc(cnn2)C(=O)N 7697db3e4017786f869a38a0ea233a19 [0,0,0,0,1,1|2,0,0]=4 208 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cc(cnn2)C(=O)O c67be21bf7248f8aa2f1601066591b5d [0,0,0,0,1,1|1,0,0]=3 209 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cc(ncn2)C(=O)N 28c30b9e4392c6c02defcffef78aa92e [0,0,0,0,1,1|2,0,0]=4 210 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cc(ncn2)C(=O)O 7f889b080c184540f579bc5a6645d341 [0,0,0,0,1,1|1,0,0]=3 211 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cccc(c2)C(=O)O 716d7de43db8592f1f9597d3286f9f6a [0,0,0,0,1,1|2,0,0]=4 212 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2ccnc(c2)C(=O)O f044bd3d03dd5d5134c0d1211de593a9 [0,0,0,0,1,1|2,0,0]=4 213 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cncc(c2)C(=O)N d52689c09cc316255a807719ac1aced1 [0,0,0,0,1,1|2,0,0]=4 214 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cncc(c2)C(=O)O bf6770a7a4f3987c9e12fb00cd4807c3 [0,0,0,0,1,1|1,0,0]=3 215 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cncc(n2)C(=O)O cf946dbd9dab9c332ab1c0482c67e483 [0,0,0,0,1,1|2,0,0]=4 216 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2cnnc(c2)C(=O)O 0d2dcc0b88b9575da57e344bbfc7f2e6 [0,0,0,0,1,1|2,0,0]=4 217 B23R2.12955008 CC(C)(C)Oc1ccc(cc1C#N)c2nccc(n2)C(=O)O f972bdca84ea0a2808f47d9c0fea76e6 [0,0,0,0,1,1|2,0,0]=4 218 B23R2.12955008 CC(C)(C)Oc1ncc(cc1C#N)c2cc(ccn2)C(=O)O 907f343f415d68bfea0792019b645f01 [0,0,0,0,1,1|2,0,0]=4 219 B23R2.12955008 CC(C)(C)Oc1ncc(cc1C#N)c2cc(cnn2)C(=O)O 166c39fe1622fda72f7071b3a31c851c [0,0,0,0,1,1|2,0,0]=4 220 B23R2.12955008 CC(C)(C)Oc1ncc(cc1C#N)c2cncc(c2)C(=O)O a2c2880248c8e074650e0bb02759fa06 [0,0,0,0,1,1|2,0,0]=4