0 B12R1.5 C#Cc1ccc(cc1)N(C)CO 61305a9e3b3e6ac419a59c5dd646ebcf [0,1,0,0,0,0|2,0,1]=4 1 B12R1.5 C=Cc1ccc(cn1)N(C)CC d21024e5325729c44ce0b1d720240300 [0,1,0,0,0,0|3,0,0]=4 2 B12R1.5 CCN(C)c1ccc(cc1)C=O a0fd570706483771aa49a936d2f3cb21 [0,1,0,0,0,0|1,0,0]=2 3 B12R1.5 CCN(C)c1ccc(cc1)CO 0442e642b28dc09b9f3aa7725617709c [0,1,0,0,0,0|1,0,2]=4 4 B12R1.5 CCN(C)c1ccc(cc1)NO a1b55ac79d706b4a728ba723b7fae4a6 [0,1,0,0,0,0|2,0,1]=4 5 B12R1.5 CCN(C)c1ccc(cc1)OC 06581141c2809c0bc310ea7a67bd5102 [0,1,0,0,0,0|3,0,0]=4 6 B12R1.5 CCN(C)c1ccc(cc1)SC da51693642669f4ac0f642dfc3a52b8b [0,1,0,0,0,0|3,0,0]=4 7 B12R1.5 CCN(C)c1ccc(cn1)C=O 30979ac5df8fbd35ed0865d9a1538cb1 [0,1,0,0,0,0|2,0,0]=3 8 B12R1.5 CCN(C)c1ccc(nc1)C=O 287a65cbaba4b277713cea5098a452fa [0,1,0,0,0,0|2,0,0]=3 9 B12R1.5 CCN(C)c1ccc(nn1)C=O 00ef11cebbf7b07d29a7333ebc47aa35 [0,1,0,0,0,0|3,0,0]=4 10 B12R1.5 CCN(C)c1ncc(cn1)C=O e05c13b260d3f503aa43959d32306c9a [0,1,0,0,0,0|3,0,0]=4 11 B12R1.5 CN(C=O)c1ccc(cn1)C=O a6b6d5d98c26fe3eee87d5cf07796183 [0,1,0,0,0,0|2,0,1]=4 12 B12R1.5 CN(CF)c1ccc(cc1)C=O b74eccc5ac71532d2a3bf436d8ddc0bd [0,1,0,0,0,0|1,0,0]=2 13 B12R1.5 CN(CF)c1ccc(cc1)CO a0d20042ca7674242a7497a515103065 [0,1,0,0,0,0|1,0,2]=4 14 B12R1.5 CN(CF)c1ccc(cn1)C=O 0080a7ce5632ad1fb6af0523547a8b04 [0,1,0,0,0,0|2,0,0]=3 15 B12R1.5 CN(CO)c1ccc(cc1)C#N ee2fd06259d18fb8a0aab08c79fa574a [0,1,0,0,0,0|2,0,1]=4 16 B12R1.5 CN(CO)c1ccc(cc1)C=O e1f9efc4553028d81b9cd5065fa5b275 [0,1,0,0,0,0|1,0,0]=2 17 B12R1.5 CN(CO)c1ccc(cc1)CO 5b96ff845683778ecc9957d4d3f78bea [0,1,0,0,0,0|1,0,2]=4 18 B12R1.5 CN(CO)c1ccc(cn1)C=O bdbcac187f7976eb85eecdb3e8937dd0 [0,1,0,0,0,0|2,0,0]=3 19 B12R1.5 COc1ccc(cc1)N(C)CF d39b3366aec32235dd3334b33e15739f [0,1,0,0,0,0|3,0,0]=4 20 B12R1.5 COc1ccc(cc1)N(C)CO bcd2162661e5844ae708a4240803596f [0,1,0,0,0,0|3,0,0]=4 21 B12R1.5 CSc1ccc(cc1)N(C)CF 657174a66754cb103b73779d135c77e9 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.5 CSc1ccc(cc1)N(C)CO 7392392f522a86f3fecb1588d6d5bf37 [0,1,0,0,0,0|3,0,0]=4 23 B12R1.113 CC(=O)c1ccc(cc1)NC=O 69691b9a1ab6fd140ab79e5d9301effa [0,1,0,0,0,0|1,0,1]=3 24 B12R1.113 CC(=O)c1ccc(cn1)NC=O 900198501987d2865be2dded746b454d [0,1,0,0,0,0|2,0,1]=4 25 B12R1.113 CC(=O)c1ccc(nc1)NC=O ce7836778adfc0ca222fd4e89f97cc23 [0,1,0,0,0,0|2,0,1]=4 26 B12R1.113 CC(C)c1ccc(cc1)NC=O 727afdd3875223419795a0f137a13873 [0,1,0,0,0,0|0,0,0]=1 27 B12R1.113 CC(C)c1ccc(cc1)NCF 3e7976bca83705cc206f471127e30038 [0,1,0,0,0,0|1,0,1]=3 28 B12R1.113 CC(C)c1ccc(cc1)NCO eb33daf19145d872e5119e255ddbe9f3 [0,1,0,0,0,0|0,0,2]=3 29 B12R1.113 CC(C)c1ccc(cc1)OCF a7ca380fb5af25e1b29af10fac04b737 [0,1,0,0,0,0|1,0,1]=3 30 B12R1.113 CC(C)c1ccc(cn1)NC=O d19063bbafa8835892deb8a32988e966 [0,1,0,0,0,0|1,0,0]=2 31 B12R1.113 CC(C)c1ccc(cn1)NCF 83fc0dfff69ca5d6a29e2303efc565b7 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.113 CC(C)c1ccc(cn1)NCO 670a4495da004cb7d766adfb89b0bba9 [0,1,0,0,0,0|1,0,2]=4 33 B12R1.113 CC(C)c1ccc(cn1)OCF ea98f2d456520962c6608ce56b8a46ca [0,1,0,0,0,0|2,0,1]=4 34 B12R1.113 CC(C)c1ccc(nc1)NC=O c573ea74d3c09c471975bf7132ed20a1 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.113 CC(C)c1ccc(nc1)NCF a55986cf1c02d4069985146c61801de1 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.113 CC(C)c1ccc(nc1)NCO 80e2d0e6195acbe6acebe7a58996836c [0,1,0,0,0,0|1,0,2]=4 37 B12R1.113 CC(C)c1cnc(cn1)NC=O ca2819166fcb04e6e860533618b8785a [0,1,0,0,0,0|2,0,0]=3 38 B12R1.113 CC(C)c1ncc(cn1)NC=O 200abe039c2055751abaedbd680e72f1 [0,1,0,0,0,0|2,0,0]=3 39 B12R1.113 CC(O)c1ccc(cc1)NC=O 86a5fa456af9204a70128e3ffbf07737 [0,1,0,0,0,0|1,0,0]=2 40 B12R1.113 CC(O)c1ccc(cc1)NCF 415eb4e86e110a1f3cf661d70c95cd44 [0,1,0,0,0,0|2,0,1]=4 41 B12R1.113 CC(O)c1ccc(cc1)NCO 74c9a6dba78830dd2b3ade1c19be4252 [0,1,0,0,0,0|1,0,2]=4 42 B12R1.113 CCNc1ccc(cc1)C(C)C 51a8c28fb0c90cbb58429f7341333aa1 [0,1,0,0,0,0|1,0,1]=3 43 B12R1.113 CCNc1ccc(cc1)C(C)O 06a84e7b07090916a8cf8a0827876e87 [0,1,0,0,0,0|2,0,1]=4 44 B12R1.113 CCNc1ccc(cc1)N(C)C 60030f7164ecf2eb4bb7228d01f9e891 [0,1,0,0,0,0|2,0,1]=4 45 B12R1.113 CCNc1ccc(cn1)C(C)C d2e6a0d6cc09ca6d417114638c237756 [0,1,0,0,0,0|2,0,1]=4 46 B12R1.113 CCNc1ccc(nc1)C(C)C 68c608f42bd77503e95b3558570f4440 [0,1,0,0,0,0|2,0,1]=4 47 B12R1.113 CCOc1ccc(cc1)C(C)C 1b1f3178a4d7a5d36377a94e34a4b641 [0,1,0,0,0,0|1,0,1]=3 48 B12R1.113 CCOc1ccc(cc1)N(C)C 7c0c8727d2634fbddeec9ff1c3c4e652 [0,1,0,0,0,0|2,0,1]=4 49 B12R1.113 CCOc1ccc(nc1)C(C)C 4852f36066164051e07a5e5ff729272a [0,1,0,0,0,0|2,0,1]=4 50 B12R1.113 CN(C)c1ccc(cc1)NC=O 8adf36900254bf95cebbc5385341a0c7 [0,1,0,0,0,0|1,0,0]=2 51 B12R1.113 CN(C)c1ccc(cc1)NCF 437f082f40bedbd6371cca3e1fceffea [0,1,0,0,0,0|2,0,1]=4 52 B12R1.113 CN(C)c1ccc(cc1)NCO 2884d3e81780a7727e8e3321fbd5b486 [0,1,0,0,0,0|1,0,2]=4 53 B12R1.113 CN(C)c1ccc(cc1)OCF e7783933c096400ab0ca8921de39e5cd [0,1,0,0,0,0|2,0,1]=4 54 B12R1.113 CN(C)c1ccc(cn1)NC=O 0baf17e73332fb4289a564be7397f778 [0,1,0,0,0,0|2,0,0]=3 55 B12R1.113 CN(C)c1ccc(nc1)NC=O 1b7dd58b77eaf77d6e78ac9637a959f0 [0,1,0,0,0,0|2,0,0]=3 56 B12R1.113 CS(=O)c1ccc(cc1)NC=O e4dea300fd44631e301ef72ebeb0d807 [0,1,0,0,0,0|2,0,0]=3 57 B12R1.113 NC(=O)c1ccc(cc1)NC=O 9fb7ff943e0b6470f967c00a5d8db744 [0,1,0,0,0,0|2,0,1]=4 58 B12R1.113 NC(=S)c1ccc(cc1)NC=O 82b3adbb9c7111c98202a20658e1e583 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.113 O=CNc1ccc(cc1)[N+](=O)[O-] bee5e823f09a2e0c205f3cea7c80dedf [0,1,0,0,0,0|3,0,0]=4 60 B12R1.113 O=CNc1ccc(cn1)C(F)F 72a20b75d6c48c0949e46cfd488a21c1 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.113 O=CNc1ccc(nc1)C(F)F 0d5589610ebcc1ecd2fb243a159a2879 [0,1,0,0,0,0|3,0,0]=4 62 B10R0.82 C=C(C=O)OCC(=O)C(C)C 2da5c8cec11f636623b4066021f69f3f [0,0,1,0,0,0|2,0,1]=4 63 B12R1.4 C#Cc1ccc(cc1)NC(C)C faa63853dbda923b2c126c30ff9bfa23 [0,0,0,0,0,1|1,0,1]=3 64 B12R1.4 C#Cc1ccc(cc1)OC(C)C e3463961332c304b58817ff8d4b0b05b [0,0,0,0,0,1|1,0,1]=3 65 B12R1.4 C#Cc1ccc(cn1)NC(C)C 3f67e8459058a51b0306a19bed99fa5a [0,0,0,0,0,1|2,0,1]=4 66 B12R1.4 C#Cc1ccc(nc1)NC(C)C 96ffe2aa92a1c5973aaeebcdc64a3003 [0,0,0,0,0,1|2,0,1]=4 67 B12R1.4 C#Cc1ccc(nc1)OC(C)C 4391ceba5f5289a90ee935ea4c3784b7 [0,0,0,0,0,1|2,0,1]=4 68 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 380a53a81d93fd211cb75b86b1064f57 [0,0,0,0,0,1|2,0,1]=4 69 B12R1.4 C=Cc1ccc(cc1)NC(C)C 21a2df0a267e794d3f3240b8e563ad23 [0,0,0,0,0,1|1,0,0]=2 70 B12R1.4 C=Cc1ccc(cc1)OC(C)C c83cc47632832c79bb2fdd3080632eb6 [0,0,0,0,0,1|1,0,0]=2 71 B12R1.4 C=Cc1ccc(nc1)NC(C)C 7e77370acfc8cab93a846382ec375567 [0,0,0,0,0,1|2,0,0]=3 72 B12R1.4 C=Cc1cnc(nc1)NC(C)C 3d4b05ec864691c7548e287605770495 [0,0,0,0,0,1|3,0,0]=4 73 B12R1.4 CC(=O)Nc1ccc(cc1)C=O 2018ba8cd05dd8ce26ca61fb61d10b19 [0,0,0,0,0,1|1,0,1]=3 74 B12R1.4 CC(=O)Nc1ccc(cn1)C=O 07c27ee782d250b37088a4ef3a24f42a [0,0,0,0,0,1|2,0,1]=4 75 B12R1.4 CC(=O)Nc1ccc(nc1)C=O 49e7cf4a9ba9e149eb2971e237e58703 [0,0,0,0,0,1|2,0,1]=4 76 B12R1.4 CC(C)Nc1ccc(cc1)C#N 34a536a6643fc1e460a58fed59492391 [0,0,0,0,0,1|1,0,1]=3 77 B12R1.4 CC(C)Nc1ccc(cc1)C=O 62ba5962698d35c68b71a115e0b568ab [0,0,0,0,0,1|0,0,0]=1 78 B12R1.4 CC(C)Nc1ccc(cc1)CO 2893829c5855e3498ec30daf5a92b3f9 [0,0,0,0,0,1|0,0,2]=3 79 B12R1.4 CC(C)Nc1ccc(cn1)C#N ae0198af1597561212db103cfb9e7f9f [0,0,0,0,0,1|2,0,1]=4 80 B12R1.4 CC(C)Nc1ccc(cn1)C=O c905645683820d20a01ce77b17f9ce6b [0,0,0,0,0,1|1,0,0]=2 81 B12R1.4 CC(C)Nc1ccc(cn1)CCl 7e3af2c29d05bc9555a7c4d5c90afe70 [0,0,0,0,0,1|2,0,1]=4 82 B12R1.4 CC(C)Nc1ccc(cn1)CO abb33c51cfa1e5e26bd3cd712f07ef95 [0,0,0,0,0,1|1,0,2]=4 83 B12R1.4 CC(C)Nc1ccc(nc1)C#N 298612b442c05517bd6a207f441476a7 [0,0,0,0,0,1|2,0,1]=4 84 B12R1.4 CC(C)Nc1ccc(nc1)C=O 0ea93230a92b171687c3dbcbb8c869fc [0,0,0,0,0,1|1,0,0]=2 85 B12R1.4 CC(C)Nc1ccc(nc1)CO 366f9bf961ca1d27001fd1a89b57f52d [0,0,0,0,0,1|1,0,2]=4 86 B12R1.4 CC(C)Nc1cnc(cn1)C=O 2a326d38420b9bd6be4f89bdc6f8148e [0,0,0,0,0,1|2,0,0]=3 87 B12R1.4 CC(C)Nc1ncc(cn1)C=O 96427161bd5df79d9b1866f53bfadf55 [0,0,0,0,0,1|2,0,0]=3 88 B12R1.4 CC(C)Oc1ccc(cc1)C#N 847015a9d4bd458f57d946e8956cc9c1 [0,0,0,0,0,1|1,0,1]=3 89 B12R1.4 CC(C)Oc1ccc(cc1)C=O 2397d983c0762938a0582225e128d3b0 [0,0,0,0,0,1|0,0,0]=1 90 B12R1.4 CC(C)Oc1ccc(cc1)N=O e461c6ac1751e2be8c322e20efd1c111 [0,0,0,0,0,1|1,0,0]=2 91 B12R1.4 CC(C)Oc1ccc(cn1)C#N 7c9bfc07996e71613d168377ef1bb08c [0,0,0,0,0,1|2,0,1]=4 92 B12R1.4 CC(C)Oc1ccc(cn1)C=O bd1ce5340c4711a9faef60a6c5e0d92e [0,0,0,0,0,1|1,0,0]=2 93 B12R1.4 CC(C)Oc1ccc(nc1)C#N a9a35fb8783ffcac2965b83de803b107 [0,0,0,0,0,1|2,0,1]=4 94 B12R1.4 CC(C)Oc1ccc(nc1)C=O 6bb7bf8fb082dfb640d3f4945d00337a [0,0,0,0,0,1|1,0,0]=2 95 B12R1.4 CC(C)Oc1ccc(nn1)C=O 74eb9c0dc7df37a018257696f9c22d2c [0,0,0,0,0,1|2,0,0]=3 96 B12R1.4 CC(C)Oc1ncc(cn1)C=O ae30e139a7bfab29719cf0691108ca98 [0,0,0,0,0,1|2,0,0]=3 97 B12R1.4 CCc1ccc(cc1)NC(C)C 3ed99f3debb7261e07191e58d03b9e98 [0,0,0,0,0,1|1,0,1]=3 98 B12R1.4 CCc1ccc(cc1)OC(C)C c47fe5ab2b90199662fd8ab843de2974 [0,0,0,0,0,1|1,0,1]=3 99 B12R1.4 CCc1ccc(cn1)NC(C)C 4bdaf5322c1240dc87cfbd7d6c48b9fc [0,0,0,0,0,1|2,0,1]=4 100 B12R1.4 CCc1ccc(nc1)NC(C)C dd63af80aa1271de99e01e6619c2e3f7 [0,0,0,0,0,1|2,0,1]=4 101 B12R1.4 CCc1ccc(nc1)OC(C)C 85b55bfa1c4b791a2b861f6df3adb4e6 [0,0,0,0,0,1|2,0,1]=4 102 B12R1.4 COc1ccc(cc1)NC(C)C ad2f50ef0d3f01d7a0822fd855d76ce7 [0,0,0,0,0,1|2,0,0]=3 103 B12R1.4 COc1ccc(cc1)OC(C)C 8ab9bf357f184746ac612b947f092324 [0,0,0,0,0,1|2,0,0]=3 104 B12R1.4 COc1ccc(cn1)NC(C)C c3362d4fb4f2d791ad1ef8955849e43c [0,0,0,0,0,1|3,0,0]=4 105 B12R1.4 COc1ccc(cn1)OC(C)C 9ef739a38a83780f0b70a82f0fce73c0 [0,0,0,0,0,1|3,0,0]=4 106 B12R1.4 COc1ccc(nc1)NC(C)C d8b283d3974bedaeccfeb1897f8e542c [0,0,0,0,0,1|3,0,0]=4 107 B12R1.4 COc1ccc(nc1)OC(C)C c7cef5a8d6d24506e98d43f994220db1 [0,0,0,0,0,1|3,0,0]=4 108 B12R1.4 CSc1ccc(cc1)NC(C)C 8046d202268d2a850a12d3ac6096b479 [0,0,0,0,0,1|2,0,0]=3 109 B12R1.4 CSc1ccc(cc1)OC(C)C e0501229b5d29bc5e4bd3d8921e409c4 [0,0,0,0,0,1|2,0,0]=3 110 B12R1.4 CSc1ccc(cn1)NC(C)C 4c994a6cca553e3e701cafacf129c7cd [0,0,0,0,0,1|3,0,0]=4 111 B12R1.4 CSc1ccc(cn1)OC(C)C c8b09d15930bea4a2429fe6592a6bb58 [0,0,0,0,0,1|3,0,0]=4 112 B12R1.4 CSc1ccc(nc1)NC(C)C d27e4c74853a74d904af4b85d2431fa4 [0,0,0,0,0,1|3,0,0]=4 113 B9R0.24 C=C(CC)COC(=C)C=O 5c18cade9a1def0b3423eb7521b89d38 [1,0,1,0,0,0|1,0,1]=4 114 B11R1.83 C#Cc1ccc(cc1)NC=O 95370e205b84943a487b32541a22dd96 [1,1,0,0,0,0|0,0,2]=4 115 B11R1.83 C#Cc1ccc(cc1)NCC fcc2f797143393a826235cab51016e1d [1,1,0,0,0,0|1,0,1]=4 116 B11R1.83 C#Cc1ccc(cc1)OCC 7605fc1756b7b37617def1215e5772aa [1,1,0,0,0,0|1,0,1]=4 117 B11R1.83 C=Cc1ccc(cc1)NCC 817ec74810f825a0e36709628dff4396 [1,1,0,0,0,0|1,0,0]=3 118 B11R1.83 C=Cc1ccc(cc1)NCF 0a4b6dd3c2bcc6ff056575d646b45479 [1,1,0,0,0,0|2,0,0]=4 119 B11R1.83 C=Cc1ccc(cc1)NCO 38b24d34161eea2db824a391ffef5464 [1,1,0,0,0,0|2,0,0]=4 120 B11R1.83 C=Cc1ccc(cc1)OCC 2dfc252e05f2c69f9afd57ad07934f94 [1,1,0,0,0,0|1,0,0]=3 121 B11R1.83 C=Cc1ccc(cc1)OCF 1caa6521b77ee34492a62573e025620c [1,1,0,0,0,0|2,0,0]=4 122 B11R1.83 C=Cc1ccc(nc1)NCC 38b06eabaa1490c709e67ef96f75cf12 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.83 CCNc1ccc(cc1)C#N d464195f47e6ee547243ae4d17a8adf2 [1,1,0,0,0,0|1,0,1]=4 124 B11R1.83 CCNc1ccc(cc1)C=O 5b1da36ecdd403f54386923bf3cd85f6 [1,1,0,0,0,0|0,0,0]=2 125 B11R1.83 CCNc1ccc(cc1)CC 6ead712ee50631311185c30d29cb552f [1,1,0,0,0,0|1,0,1]=4 126 B11R1.83 CCNc1ccc(cc1)CO ebf5cabcdccf03d422420491e8a9bb88 [1,1,0,0,0,0|0,0,2]=4 127 B11R1.83 CCNc1ccc(cc1)OC a4b97f177bf546e094eec7eb3e7f66dd [1,1,0,0,0,0|2,0,0]=4 128 B11R1.83 CCNc1ccc(cc1)SC 2ca52da4c1da9cde62caa1a44419ff80 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.83 CCNc1ccc(cn1)C=O dd4312795d8088c2d75d58fa4a7fbc09 [1,1,0,0,0,0|1,0,0]=3 130 B11R1.83 CCNc1ccc(nc1)C=O e9ae26db13ed7f812a2c4aa039ca3f6c [1,1,0,0,0,0|1,0,0]=3 131 B11R1.83 CCNc1cnc(cn1)C=O 453fe06af65607cc6c41deed5c412d94 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.83 CCNc1ncc(cn1)C=O 583d2a6d5769f6435b4c5bc3ed719aed [1,1,0,0,0,0|2,0,0]=4 133 B11R1.83 CCOc1ccc(cc1)C#N 9b013ab74d3621a0af682769151817d3 [1,1,0,0,0,0|1,0,1]=4 134 B11R1.83 CCOc1ccc(cc1)C=O a91e11e6046c836fde6a9c8c50bcee5f [1,1,0,0,0,0|0,0,0]=2 135 B11R1.83 CCOc1ccc(cc1)CC 130be86bb5623a5d2837998dae082a29 [1,1,0,0,0,0|1,0,1]=4 136 B11R1.83 CCOc1ccc(cc1)N=O 225b842c68d4b1757d171cfe2fef0d02 [1,1,0,0,0,0|1,0,0]=3 137 B11R1.83 CCOc1ccc(cc1)OC 78aacf22e7f5ffe52b6720f42ae387fa [1,1,0,0,0,0|2,0,0]=4 138 B11R1.83 CCOc1ccc(cc1)SC 5d7f5467819db3ffd93e8fef63951787 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.83 CCOc1ccc(cn1)C=O 3b8b64fa974f689fe9a33594fdaa0596 [1,1,0,0,0,0|1,0,0]=3 140 B11R1.83 CCOc1ccc(nc1)C=O 202597c6655fff3a69ca3db66d69956a [1,1,0,0,0,0|1,0,0]=3 141 B11R1.83 CCOc1ccc(nn1)C=O 4e29dcecb02e5059f2afcc4239a5eefc [1,1,0,0,0,0|2,0,0]=4 142 B11R1.83 CCOc1ncc(cn1)C=O 41202a4922bca945b17b16afac38237d [1,1,0,0,0,0|2,0,0]=4 143 B11R1.83 CCc1ccc(cc1)NC=O 3e8610d99c2c76fe0a620af2485f9af7 [1,1,0,0,0,0|0,0,0]=2 144 B11R1.83 CCc1ccc(cc1)NCF 85d93b0251dae4defb6a8b0684fd5c6f [1,1,0,0,0,0|1,0,1]=4 145 B11R1.83 CCc1ccc(cc1)NCO 2632ca5f43af05f14260cfd180617e8c [1,1,0,0,0,0|0,0,2]=4 146 B11R1.83 CCc1ccc(cc1)OCF 7fda0752555f0e54fed3e99d547f54fb [1,1,0,0,0,0|1,0,1]=4 147 B11R1.83 CCc1ccc(cn1)NC=O 27d6453a5d8b728429751b40bd51b8df [1,1,0,0,0,0|1,0,0]=3 148 B11R1.83 CCc1ccc(nc1)NC=O 18bf2d8c4741781967fd58d448623b4c [1,1,0,0,0,0|1,0,0]=3 149 B11R1.83 CCc1ccc(nn1)NC=O 47e5131be12998513a3b46b608e58bfa [1,1,0,0,0,0|2,0,0]=4 150 B11R1.83 CCc1cnc(cn1)NC=O 9a0c80736b8d7fc82f28578339dc28d0 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.83 CCc1ncc(cn1)NC=O 6741a10ac312f345a4ecadc565e3d4cd [1,1,0,0,0,0|2,0,0]=4 152 B11R1.83 COc1ccc(cc1)NC=O ac87369c17c8363b04f17408dd3a8237 [1,1,0,0,0,0|1,0,0]=3 153 B11R1.83 COc1ccc(cn1)NC=O d82d033ac2ee0dd752f2c90ad770ea29 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.83 COc1ccc(nc1)NC=O bf678dc9ba2fd7220284555df5bbb75b [1,1,0,0,0,0|2,0,0]=4 155 B11R1.83 CSc1ccc(cc1)NC=O 9ba6c9bfa858e9ab1b1e9ea1b6cf97ce [1,1,0,0,0,0|1,0,0]=3 156 B11R1.83 CSc1ccc(cn1)NC=O 0995d7efa9e1a7f8f39f3d0d10cb504d [1,1,0,0,0,0|2,0,0]=4 157 B11R1.83 O=CNc1ccc(cc1)CO 02da734ee2802902e3cce3607911d666 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.83 O=CNc1ccc(cn1)CCl 9296d0909f463187b48ad98b7c3d8231 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.83 O=CNc1ccc(cn1)CO 798f2a5c2637fd89722810ea7cd1c1d7 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.83 O=CNc1ccc(nc1)CO 2a68fa0e6cda46daf7160f28e3062865 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.83 O=Cc1ccc(cc1)NCF 6e9507808f661692c4995ce01d7149d7 [1,1,0,0,0,0|1,0,0]=3 162 B11R1.83 O=Cc1ccc(cc1)NCO 5d1b19988396e75b9401946c178d10c0 [1,1,0,0,0,0|1,0,0]=3 163 B11R1.83 O=Cc1ccc(cc1)OCF 1650bb97f47d4d35a5c8149a03d0d3f8 [1,1,0,0,0,0|1,0,0]=3 164 B11R1.83 O=Cc1ccc(cn1)NCF 72bc126bbd4bfcffb3b226662f3e38c0 [1,1,0,0,0,0|2,0,0]=4 165 B11R1.83 O=Cc1ccc(cn1)NCO 788d6f4633f44c97a001f4d759d59a7c [1,1,0,0,0,0|2,0,0]=4 166 B11R1.83 O=Cc1ccc(cn1)OCF c94a6b209178c693c56e3e32144380b4 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.83 O=Cc1ccc(nc1)NCF f1bfde05b648245a2d8978d1a14a3f7a [1,1,0,0,0,0|2,0,0]=4 168 B11R1.83 O=Cc1ccc(nc1)NCO 7224f6f28fcf8d6ba77bb1da54e1ed73 [1,1,0,0,0,0|2,0,0]=4 169 B11R1.83 O=Cc1ccc(nc1)OCF 10cafffee4c0f03191e10584fbcd9110 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.83 O=Nc1ccc(cc1)OCF 4703797660d3f0cf5ebd83d127a70814 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.22 CCN(C)c1ccc(cc1)F 37e2d475a9bd3cfcf296a94fc69fd067 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.22 CCN(C)c1ccc(cc1)I 6deef7aec400603f68eb68f0833942ec [1,1,0,0,0,0|2,0,0]=4 173 B11R1.22 CCN(C)c1ccc(cc1)S 429f96f94511567839fe68b5edd62f1c [1,1,0,0,0,0|1,1,0]=4 174 B11R1.22 CN(CF)c1ccc(cc1)Br 6b91b8da88ddbfb295c2dccdb6cb4076 [1,1,0,0,0,0|2,0,0]=4 175 B11R1.22 CN(CF)c1ccc(cc1)Cl 0c4cb302bade12f5a411b01a9042b3ea [1,1,0,0,0,0|2,0,0]=4 176 B11R1.22 CN(CF)c1ccc(cc1)F 7a7162e57e22a4f5e6a55d2c6d204d3d [1,1,0,0,0,0|2,0,0]=4 177 B11R1.22 CN(CF)c1ccc(cc1)I 6d998585b1c8e8e7964bc459bdd74230 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.22 CN(CF)c1ccc(cc1)S 790104648dfcde077abfb3f2fb190f26 [1,1,0,0,0,0|1,1,0]=4 179 B11R1.22 CN(CO)c1ccc(cc1)Br a0ee612d9ade0f057f40eda0edee63d6 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.22 CN(CO)c1ccc(cc1)Cl 2c0dfaf13b4e02b467d222656644d816 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.22 CN(CO)c1ccc(cc1)F c1ecf99a3d9f55a2562607c88c44d1b8 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.22 CN(CO)c1ccc(cc1)I 148086324dd93cd760089e4e94a122ba [1,1,0,0,0,0|2,0,0]=4 183 B11R1.22 CN(CO)c1ccc(cc1)S 7e6f64a1230a5e349b82adbdac7f2cd1 [1,1,0,0,0,0|1,1,0]=4 184 B11R1.22 Cc1ccc(cc1)N(C)CF d9ca75efcf22688224e11802328b1cd1 [1,1,0,0,0,0|1,0,1]=4 185 B11R1.22 Cc1ccc(cc1)N(C)CO 3f90488aa46443ae7ceb46a9828e79d3 [1,1,0,0,0,0|1,0,1]=4 186 B11R1.44 CCN(C)c1c[nH]c(c1)C=O 35f01282d7f3c7785e15097af0907304 [0,1,0,0,1,0|2,0,0]=4 187 B11R1.44 CCN(C)c1cc(c[nH]1)C=O c9a68f99a21335b3e47d3e9ca18c7ee2 [0,1,0,0,1,0|2,0,0]=4 188 B11R1.44 CCN(C)c1cc(cs1)C=O f69289a70ebf62f1b9ce2ec8d3d11eb4 [0,1,0,0,1,0|2,0,0]=4 189 B11R1.44 CCN(C)c1ccc([nH]1)C=O 08ee71974c4bcd94b2aa08497c8a037e [0,1,0,0,1,0|2,0,0]=4 190 B11R1.44 CCN(C)c1ccc(o1)C=O aace4d2c96158323a7286e080bdf28c1 [0,1,0,0,1,0|2,0,0]=4 191 B11R1.44 CCN(C)c1ccc(s1)C=O 4932cda769bfe4c238b9b527de2ed269 [0,1,0,0,1,0|2,0,0]=4 192 B11R1.44 CCN(C)c1coc(c1)C=O bb8c06110b80e77616b926aa6042c669 [0,1,0,0,1,0|2,0,0]=4 193 B11R1.124 CC(C)c1cc(no1)NC=O f61c87102ead68532957fed9fc8fa91b [0,1,0,0,1,0|2,0,0]=4 194 B11R1.124 CC(C)c1cc(on1)NC=O 4f824ba8ff893e4eb309385c47997f06 [0,1,0,0,1,0|2,0,0]=4 195 B11R1.124 CC(C)c1cnc(s1)NC=O fb9008a8d73fbca60d9fdfdcf002dfa9 [0,1,0,0,1,0|2,0,0]=4 196 B11R1.124 CC(C)c1coc(n1)NC=O 2977a86b546e5ee0e8b6eac5fb2b582d [0,1,0,0,1,0|2,0,0]=4 197 B11R1.124 CC(C)n1cc(cn1)NC=O 365fa7eb6d36b0d2c051509bcb1d76b3 [0,1,0,0,1,0|2,0,0]=4 198 B13R1.4 C=Cc1ccc(cn1)NC(C)(C)C 0a63ca797649064ea882affe29cad81d [0,1,0,0,0,1|2,0,0]=4 199 B13R1.4 CC(C)(C)Nc1ccc(nc1)C=O 8683d66cf5607aa1e17a47483c6b3129 [0,1,0,0,0,1|1,0,0]=3 200 B13R1.4 CC(C)(C)Nc1cnc(nc1)C=O 7a385d4736ed1b9194ab35ef776f0279 [0,1,0,0,0,1|2,0,0]=4 201 B13R1.5 C#CC(C)Nc1ccc(cc1)C=O bb136c6037c195c392777fc29ad0c14a [0,1,0,0,0,1|0,0,1]=3 202 B13R1.5 C#CC(C)Nc1ccc(cn1)C=O 840736be578b063a9eba62096abee456 [0,1,0,0,0,1|1,0,1]=4 203 B13R1.5 C#CC(C)Nc1ccc(nc1)C=O aed320f5609b7d1108f5bd944b6b0471 [0,1,0,0,0,1|1,0,1]=4 204 B13R1.5 C#CC(C)Oc1ccc(cc1)C=C ada21a46327168ddf78f0936b83734d8 [0,1,0,0,0,1|1,0,1]=4 205 B13R1.5 C#CC(C)Oc1ccc(cc1)C=O 04b7fa601e9786f994fe390b656ed92c [0,1,0,0,0,1|0,0,1]=3 206 B13R1.5 C#CC(C)Oc1ccc(cn1)C=O dca114c587f87e01d4325eed44f91510 [0,1,0,0,0,1|1,0,1]=4 207 B13R1.5 C#CC(C)Oc1ccc(nc1)C=O 831b6bb73355b4d6d82609efd859e58e [0,1,0,0,0,1|1,0,1]=4 208 B13R1.5 C#Cc1ccc(cc1)NC(C)CC 5c24ef33c8e355d551e502ec1b84ce42 [0,1,0,0,0,1|1,0,1]=4 209 B13R1.5 C#Cc1ccc(cc1)OC(C)CC 14b48582d680031a171adfbead381ea4 [0,1,0,0,0,1|1,0,1]=4 210 B13R1.5 C=CC(C)Nc1ccc(cc1)C=O 7368c8f126a9a7196545c2e9a8e978e3 [0,1,0,0,0,1|0,0,1]=3 211 B13R1.5 C=CC(C)Nc1ccc(cn1)C=O 76e87496435b2349125e167b3c239855 [0,1,0,0,0,1|1,0,1]=4 212 B13R1.5 C=CC(C)Nc1ccc(nc1)C=O d41706ad428a0d7e9260138569bfcbba [0,1,0,0,0,1|1,0,1]=4 213 B13R1.5 C=CC(C)Oc1ccc(cc1)C=O 315aed7b2e2836516e21be54d340cbc8 [0,1,0,0,0,1|0,0,1]=3 214 B13R1.5 C=CC(C)Oc1ccc(cc1)N=O 370a5e6626a7f5f9408928c71221870b [0,1,0,0,0,1|1,0,1]=4 215 B13R1.5 C=CC(C)Oc1ccc(cn1)C=O ed5bbf3da9bf77bfa7f6c4e484459de9 [0,1,0,0,0,1|1,0,1]=4 216 B13R1.5 C=CC(C)Oc1ccc(nc1)C=O b36e0eb81635c9de6a26ddf2cab9a2fe [0,1,0,0,0,1|1,0,1]=4 217 B13R1.5 C=Cc1ccc(cc1)CN(C)CC 69ee1034f84ef463682ca69c64a0c21f [0,1,0,0,0,1|2,0,0]=4 218 B13R1.5 C=Cc1ccc(cc1)NC(C)C=C e33b8a0254d0bc411dc9385c81a248ad [0,1,0,0,0,1|1,0,1]=4 219 B13R1.5 C=Cc1ccc(cc1)NC(C)C=O 5eab6c8ef1f15eb2fea7a94490e47121 [0,1,0,0,0,1|1,0,1]=4 220 B13R1.5 C=Cc1ccc(cc1)NC(C)CC 873cf530b192fab4da49ec489fbb8887 [0,1,0,0,0,1|1,0,0]=3 221 B13R1.5 C=Cc1ccc(cc1)NC(C)CO cc9dbf835493bd25915c45ff5cd42955 [0,1,0,0,0,1|1,0,0]=3 222 B13R1.5 C=Cc1ccc(cc1)N[C@@H](C)CO 9f6b807d0f72f7056e1331810b9b93ad [0,1,0,0,0,1|1,0,0]=3 223 B13R1.5 C=Cc1ccc(cc1)N[C@H](C)C=O 9df1b29b9e4557d0d6bb72183f09f720 [0,1,0,0,0,1|1,0,1]=4 224 B13R1.5 C=Cc1ccc(cc1)N[C@H](C)CO f0f36a4b0370c763175fe2f28e10343c [0,1,0,0,0,1|1,0,0]=3 225 B13R1.5 C=Cc1ccc(cc1)OC(C)C#N 665069e21a3cecdd375c9187df938dc8 [0,1,0,0,0,1|1,0,1]=4 226 B13R1.5 C=Cc1ccc(cc1)OC(C)C=C 159e47468063d3f18e09302e3ba88a53 [0,1,0,0,0,1|1,0,1]=4 227 B13R1.5 C=Cc1ccc(cc1)OC(C)C=O 2b8ac04e15f5a9d77c8f03b94391caed [0,1,0,0,0,1|1,0,1]=4 228 B13R1.5 C=Cc1ccc(cc1)OC(C)CC f5ff78283d509e8ce073265314ba808d [0,1,0,0,0,1|1,0,0]=3 229 B13R1.5 C=Cc1ccc(cc1)O[C@H](C)C=O 7bf1edf1b725699d385942548af9a8a8 [0,1,0,0,0,1|1,0,1]=4 230 B13R1.5 C=Cc1ccc(cn1)NC(C)CC 4f3c5c110002991d7e9863861ef884eb [0,1,0,0,0,1|2,0,0]=4 231 B13R1.5 C=Cc1ccc(cn1)NC(C)CO 08779c888e2d5973ad6e8ba30237ae71 [0,1,0,0,0,1|2,0,0]=4 232 B13R1.5 C=Cc1ccc(cn1)N[C@@H](C)CC d1bfd3f1bf8d9fc67110ef9d35580370 [0,1,0,0,0,1|2,0,0]=4 233 B13R1.5 C=Cc1ccc(cn1)N[C@@H](C)CO c004eab85a5449db977e0196bb3305af [0,1,0,0,0,1|2,0,0]=4 234 B13R1.5 C=Cc1ccc(cn1)N[C@H](C)CC 05792c19cb9a3b081218fc0c73449a7a [0,1,0,0,0,1|2,0,0]=4 235 B13R1.5 C=Cc1ccc(cn1)N[C@H](C)CO d3ffb3b1ef47c232fb3f61c1b2abc69e [0,1,0,0,0,1|2,0,0]=4 236 B13R1.5 C=Cc1ccc(nc1)NC(C)CC 5c7eb1acc835dd64c70fb2331d936b6f [0,1,0,0,0,1|2,0,0]=4 237 B13R1.5 C=Cc1ccc(nc1)NC(C)CO 5bed45fed6f1756240c0e9bf19165b0d [0,1,0,0,0,1|2,0,0]=4 238 B13R1.5 C=Cc1ccc(nc1)N[C@@H](C)CO 8ea2ab39841edc1971bc2b62904dbc1d [0,1,0,0,0,1|2,0,0]=4 239 B13R1.5 C=Cc1ccc(nc1)N[C@H](C)CO 845ebf8779dc18e5ed770df4cc87eec2 [0,1,0,0,0,1|2,0,0]=4 240 B13R1.5 CC(C#N)Nc1ccc(cn1)C=O 8cec08e4f1742880e95efb0562f3534b [0,1,0,0,0,1|1,0,1]=4 241 B13R1.5 CC(C#N)Nc1ccc(nc1)C=O 842c402bc2e9a2dbe35f3760cd616abd [0,1,0,0,0,1|1,0,1]=4 242 B13R1.5 CC(C#N)Oc1ccc(cc1)C=O 71d8cdfc13340e91565307a65e1998cc [0,1,0,0,0,1|0,0,1]=3 243 B13R1.5 CC(C#N)Oc1ccc(cn1)C=O f40fc960def1fb30e1460dc3fb312048 [0,1,0,0,0,1|1,0,1]=4 244 B13R1.5 CC(C#N)Oc1ccc(nc1)C=O 325d7c2a3dbebc6ec33c53523fd6c0fc [0,1,0,0,0,1|1,0,1]=4 245 B13R1.5 CC(C=O)Nc1ccc(cc1)C=O 541a3e7e119eb39c6df909834a715583 [0,1,0,0,0,1|0,0,1]=3 246 B13R1.5 CC(C=O)Nc1ccc(cn1)C=O 57c9a1593aad455e8dd6055a80c09518 [0,1,0,0,0,1|1,0,1]=4 247 B13R1.5 CC(C=O)Nc1ccc(nc1)C=O 0ca25c0c905805ae4c05e6333aaba046 [0,1,0,0,0,1|1,0,1]=4 248 B13R1.5 CC(C=O)Oc1ccc(cc1)C=O 3b61637f5a73bb52ab9cd9a0876b99e3 [0,1,0,0,0,1|0,0,1]=3 249 B13R1.5 CC(C=O)Oc1ccc(cc1)N=O 5df8deabe40bb0ca8af37001e5bd8e61 [0,1,0,0,0,1|1,0,1]=4 250 B13R1.5 CC(C=O)Oc1ccc(cn1)C=O ade10f1a316903860bdb175ef7d2b542 [0,1,0,0,0,1|1,0,1]=4 251 B13R1.5 CC(C=O)Oc1ccc(nc1)C=O 97ddb6ec66b07b56ab7efa8bc080ed7e [0,1,0,0,0,1|1,0,1]=4 252 B13R1.5 CC(CO)Nc1ccc(cc1)C#N b8bf70d478070420ed969f1cd8e6129a [0,1,0,0,0,1|1,0,1]=4 253 B13R1.5 CC(CO)Nc1ccc(cc1)C=O 042482260d6bcdc19265aae4cb8c3293 [0,1,0,0,0,1|0,0,0]=2 254 B13R1.5 CC(CO)Nc1ccc(cc1)CO eaa046b52ff0274e15772e35154bfeae [0,1,0,0,0,1|0,0,2]=4 255 B13R1.5 CC(CO)Nc1ccc(cn1)C=O 2154aac905315d99f2877d1a562cab86 [0,1,0,0,0,1|1,0,0]=3 256 B13R1.5 CC(CO)Nc1ccc(nc1)C=O 368946bfe48951384faf611f13bd3ebb [0,1,0,0,0,1|1,0,0]=3 257 B13R1.5 CC(CO)Nc1ccc(nn1)C=O b888c6e51b71fe3b3076fe8a90f23cc7 [0,1,0,0,0,1|2,0,0]=4 258 B13R1.5 CC(CO)Nc1cnc(cn1)C=O 0ab91309de8956364de524b04c8c6079 [0,1,0,0,0,1|2,0,0]=4 259 B13R1.5 CC(CO)Nc1cnc(nc1)C=O 3480333ae55ac2ada1f5c3816c71a764 [0,1,0,0,0,1|2,0,0]=4 260 B13R1.5 CC(CO)Nc1ncc(cn1)C=O 37f60cefb421e4013cf1597fe33e86d1 [0,1,0,0,0,1|2,0,0]=4 261 B13R1.5 CCC(C)Nc1ccc(cc1)C#N 09fc061e30f83ff7805c0982f2479c3e [0,1,0,0,0,1|1,0,1]=4 262 B13R1.5 CCC(C)Nc1ccc(cc1)C=O 226240af2ce81a2234a3b8a4616be3b7 [0,1,0,0,0,1|0,0,0]=2 263 B13R1.5 CCC(C)Nc1ccc(cc1)CO 4a04cd283f0364b557f1330241eccb1b [0,1,0,0,0,1|0,0,2]=4 264 B13R1.5 CCC(C)Nc1ccc(cc1)OC b5d98817a86b0be68e32cf6e86012842 [0,1,0,0,0,1|2,0,0]=4 265 B13R1.5 CCC(C)Nc1ccc(cc1)SC fad0774d8a7c12cdcec403821aa35328 [0,1,0,0,0,1|2,0,0]=4 266 B13R1.5 CCC(C)Nc1ccc(cn1)C=O 0f661b9c0ad3fe3abc0758ade66b538f [0,1,0,0,0,1|1,0,0]=3 267 B13R1.5 CCC(C)Nc1ccc(nc1)C=O e6a1fbd23cb83a9a99f0bd327091a983 [0,1,0,0,0,1|1,0,0]=3 268 B13R1.5 CCC(C)Nc1ccc(nn1)C=O f263c815ea58eb9ddcd1a308076610de [0,1,0,0,0,1|2,0,0]=4 269 B13R1.5 CCC(C)Nc1cnc(cn1)C=O a95e485f882bacdf7a07938123a60ba3 [0,1,0,0,0,1|2,0,0]=4 270 B13R1.5 CCC(C)Nc1cnc(nc1)C=O 0eda39975d1793e5e15a661d2ab33ca5 [0,1,0,0,0,1|2,0,0]=4 271 B13R1.5 CCC(C)Nc1ncc(cn1)C=O cc845148e193d4a4c8031cc0682da1a8 [0,1,0,0,0,1|2,0,0]=4 272 B13R1.5 CCC(C)Oc1ccc(cc1)C#N b23a03b1a2e0dc934d4a7092f5c784a9 [0,1,0,0,0,1|1,0,1]=4 273 B13R1.5 CCC(C)Oc1ccc(cc1)C=O 191b68222f6d37ec4cc42afbf6a3564f [0,1,0,0,0,1|0,0,0]=2 274 B13R1.5 CCC(C)Oc1ccc(cc1)N=O b26fd91d5d270fc2d8192742d5f35dc1 [0,1,0,0,0,1|1,0,0]=3 275 B13R1.5 CCC(C)Oc1ccc(cc1)OC ddec374cfdc0d6c49a2b118bfc4d8f4d [0,1,0,0,0,1|2,0,0]=4 276 B13R1.5 CCC(C)Oc1ccc(cc1)SC 7f1d88515aab08452fa973160753ceb2 [0,1,0,0,0,1|2,0,0]=4 277 B13R1.5 CCC(C)Oc1ccc(cn1)C=O 2094b4aa1d04cb956ca0db05590fdfce [0,1,0,0,0,1|1,0,0]=3 278 B13R1.5 CCC(C)Oc1ccc(nc1)C=O f4970a8400b716a10e526bb6ad45a112 [0,1,0,0,0,1|1,0,0]=3 279 B13R1.5 CCC(C)Oc1ccc(nn1)C=O 59b502b14a8e4050104ea7dc99ebbee4 [0,1,0,0,0,1|2,0,0]=4 280 B13R1.5 CCC(C)Oc1ncc(cn1)C=O 786e74d13cde5e55f64d4354a14badf2 [0,1,0,0,0,1|2,0,0]=4 281 B13R1.5 CCN(C)Cc1ccc(cc1)C=O 8cd8e6103ee4739510b45c52e635fb76 [0,1,0,0,0,1|1,0,0]=3 282 B13R1.5 CC[C@@H](C)Nc1ccc(cn1)C=O c43742fc926550b6b82ca0d43e466ae5 [0,1,0,0,0,1|1,0,0]=3 283 B13R1.5 CC[C@@H](C)Nc1ccc(nc1)C=O c4aa96f6b6cf95191a26f0bbd0ef116e [0,1,0,0,0,1|1,0,0]=3 284 B13R1.5 CC[C@@H](C)Nc1ccc(nn1)C=O 2b7f275a4ab65a8a413d914cad1f8c77 [0,1,0,0,0,1|2,0,0]=4 285 B13R1.5 CC[C@@H](C)Nc1cnc(nc1)C=O 2d6bba4dff5840f9f234036e8bbd4586 [0,1,0,0,0,1|2,0,0]=4 286 B13R1.5 CC[C@@H](C)Nc1ncc(cn1)C=O 328e87a124fe578053651988d65142c8 [0,1,0,0,0,1|2,0,0]=4 287 B13R1.5 CC[C@H](C)Nc1ccc(cn1)C=O 2935eef31ee265aca0e79f67cc782a59 [0,1,0,0,0,1|1,0,0]=3 288 B13R1.5 CC[C@H](C)Nc1ccc(nc1)C=O d44b04b16df7859234b880279e8f583f [0,1,0,0,0,1|1,0,0]=3 289 B13R1.5 CC[C@H](C)Nc1ccc(nn1)C=O 92660111bcfc73af18cec32108a65ca8 [0,1,0,0,0,1|2,0,0]=4 290 B13R1.5 CC[C@H](C)Nc1cnc(nc1)C=O 53c81af9826a3d581dc9fc93e818e0fd [0,1,0,0,0,1|2,0,0]=4 291 B13R1.5 CC[C@H](C)Nc1ncc(cn1)C=O 7f870db69ef1b6786d066c0215344341 [0,1,0,0,0,1|2,0,0]=4 292 B13R1.5 CCc1ccc(cc1)NC(C)CC d04ea5fa79ce87bdabdb667066c1458a [0,1,0,0,0,1|1,0,1]=4 293 B13R1.5 CCc1ccc(cc1)NC(C)CO 0831bbe771b88816bb82ad3e635c52f8 [0,1,0,0,0,1|1,0,1]=4 294 B13R1.5 CCc1ccc(cc1)OC(C)CC c2a22353d68bac44ec33ff284b2978ae [0,1,0,0,0,1|1,0,1]=4 295 B13R1.5 COc1ccc(cc1)NC(C)CO 93806937d6aafb69cb39b050e4b899f7 [0,1,0,0,0,1|2,0,0]=4 296 B13R1.5 COc1ccc(cc1)N[C@@H](C)CO 4073b5c366af28a2a4b83c690d9a0704 [0,1,0,0,0,1|2,0,0]=4 297 B13R1.5 COc1ccc(cc1)N[C@H](C)CO e4e59eb42baeb2111a01ce947e26dab7 [0,1,0,0,0,1|2,0,0]=4 298 B13R1.5 CSc1ccc(cc1)NC(C)CO 5d4b2fcff2473e557c72e7d63df64f53 [0,1,0,0,0,1|2,0,0]=4 299 B13R1.5 CSc1ccc(cc1)N[C@@H](C)CO ad4ca269c8f194fd96e4895248dd2ea7 [0,1,0,0,0,1|2,0,0]=4 300 B13R1.5 CSc1ccc(cc1)N[C@H](C)CO 7630981b5cd31a70b594d06fe596666a [0,1,0,0,0,1|2,0,0]=4 301 B13R1.5 C[C@@H](CO)Nc1ccc(cc1)C#N 7a892cf4c83eb7b2ca30c4da3457fc6c [0,1,0,0,0,1|1,0,1]=4 302 B13R1.5 C[C@@H](CO)Nc1ccc(cc1)C=O 0f2b8da61a5d7dc1e6be2c9bfee47a43 [0,1,0,0,0,1|0,0,0]=2 303 B13R1.5 C[C@@H](CO)Nc1ccc(cc1)CO 207e855f5da9e502a26e7381cf90e07f [0,1,0,0,0,1|0,0,2]=4 304 B13R1.5 C[C@@H](CO)Nc1ccc(cn1)C=O 419a31ed7b52921ad2dccc4cd070a7f0 [0,1,0,0,0,1|1,0,0]=3 305 B13R1.5 C[C@@H](CO)Nc1ccc(nc1)C=O 1576cc29b35e51c18079437e060f0779 [0,1,0,0,0,1|1,0,0]=3 306 B13R1.5 C[C@@H](CO)Nc1ccc(nn1)C=O 30d98a960334b2e0c2fc88d9b65954c3 [0,1,0,0,0,1|2,0,0]=4 307 B13R1.5 C[C@@H](CO)Nc1cnc(cn1)C=O 0b159c6128d0c83638eb89add6fc388f [0,1,0,0,0,1|2,0,0]=4 308 B13R1.5 C[C@@H](CO)Nc1cnc(nc1)C=O e87ecc92b4cda6b08df7a052a4170ff0 [0,1,0,0,0,1|2,0,0]=4 309 B13R1.5 C[C@@H](CO)Nc1ncc(cn1)C=O 9b711e38db159c5c0de2275bea7bc5a7 [0,1,0,0,0,1|2,0,0]=4 310 B13R1.5 C[C@H](C=O)Nc1ccc(cc1)C=O 8d73477557a7ea898cb9755dbef089c9 [0,1,0,0,0,1|0,0,1]=3 311 B13R1.5 C[C@H](C=O)Nc1ccc(cn1)C=O ebce8d3744b3677cd2706a8d26dce0f8 [0,1,0,0,0,1|1,0,1]=4 312 B13R1.5 C[C@H](C=O)Nc1ccc(nc1)C=O 2bc0497c2559f286cc6cb4cf092fe5e5 [0,1,0,0,0,1|1,0,1]=4 313 B13R1.5 C[C@H](C=O)Oc1ccc(cc1)C=O b46a133389ad07a8352382f7f2094c10 [0,1,0,0,0,1|0,0,1]=3 314 B13R1.5 C[C@H](C=O)Oc1ccc(cc1)N=O b40029fdc4f37cb5c47ca01669516eda [0,1,0,0,0,1|1,0,1]=4 315 B13R1.5 C[C@H](C=O)Oc1ccc(cn1)C=O f06f317184aada128bcea5bbb58300b2 [0,1,0,0,0,1|1,0,1]=4 316 B13R1.5 C[C@H](C=O)Oc1ccc(nc1)C=O b1966e11a94c35fd105991939c672adc [0,1,0,0,0,1|1,0,1]=4 317 B13R1.5 C[C@H](CO)Nc1ccc(cc1)C#N dd3cdc14db39e35feebefb21016aa206 [0,1,0,0,0,1|1,0,1]=4 318 B13R1.5 C[C@H](CO)Nc1ccc(cc1)C=O 8c25afa1912c310245352cb5ddabf13a [0,1,0,0,0,1|0,0,0]=2 319 B13R1.5 C[C@H](CO)Nc1ccc(cc1)CO 28d092764e938b8866bab64fe5752edd [0,1,0,0,0,1|0,0,2]=4 320 B13R1.5 C[C@H](CO)Nc1ccc(cn1)C=O 071780b5606f13f2095911664c6b2a43 [0,1,0,0,0,1|1,0,0]=3 321 B13R1.5 C[C@H](CO)Nc1ccc(nc1)C=O 6e081713317ba602c1435f9f94537c98 [0,1,0,0,0,1|1,0,0]=3 322 B13R1.5 C[C@H](CO)Nc1ccc(nn1)C=O eec4ee7e0f57fb0b58c814a455c49be1 [0,1,0,0,0,1|2,0,0]=4 323 B13R1.5 C[C@H](CO)Nc1cnc(cn1)C=O d23c6dbdb003791ad627d726f37517fc [0,1,0,0,0,1|2,0,0]=4 324 B13R1.5 C[C@H](CO)Nc1cnc(nc1)C=O 0ce1128eeb80d7f78d2d56dc65a0aed3 [0,1,0,0,0,1|2,0,0]=4 325 B13R1.5 C[C@H](CO)Nc1ncc(cn1)C=O 6bc2304d631c9cf9a4b27eceb8cd388c [0,1,0,0,0,1|2,0,0]=4 326 B13R1.5 N#CC(F)Nc1ccc(cc1)C=O 932d0e090a26186b79f0058ef774b0f8 [0,1,0,0,0,1|1,0,1]=4 327 B13R1.5 N#CC(F)Oc1ccc(cc1)C=O 46fb0957b68a35eb3f8ee75171caf540 [0,1,0,0,0,1|1,0,1]=4 328 B13R1.35 C#Cc1ccc(cc1Cl)NC(C)C 65e770af7f04d85e2291b22b21ef31ac [0,1,0,0,0,1|1,0,1]=4 329 B13R1.35 C#Cc1ccc(cc1F)NC(C)C 188582941b2e37e7085d50447b29bcb6 [0,1,0,0,0,1|1,0,1]=4 330 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C=O 82c8816081d8ea774c76eaadc199c244 [0,1,0,0,0,1|1,0,1]=4 331 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)C=O 13aa830758485864ad16cd7aabed5f4c [0,1,0,0,0,1|1,0,1]=4 332 B13R1.35 CC(=O)Nc1ccc(c(c1)F)C=O cc7d64d1e15e2590ee2a637e7edda450 [0,1,0,0,0,1|1,0,1]=4 333 B13R1.35 CC(=O)Nc1ccc(c(c1)O)C=O 6a43d93005b092f54f6b16da316a64e6 [0,1,0,0,0,1|1,0,1]=4 334 B13R1.35 CC(C)Nc1ccc(c(c1)Br)C#N 9b61c37de8acfdee1b9cfd183c30235c [0,1,0,0,0,1|1,0,1]=4 335 B13R1.35 CC(C)Nc1ccc(c(c1)Br)C=O a69f249489f691bbffc38761a13b2473 [0,1,0,0,0,1|0,0,0]=2 336 B13R1.35 CC(C)Nc1ccc(c(c1)Br)CO ddf67e728e73858df45a5a6dce633602 [0,1,0,0,0,1|0,0,2]=4 337 B13R1.35 CC(C)Nc1ccc(c(c1)Cl)C#N c3fdaca42d2c20c66302614626303723 [0,1,0,0,0,1|1,0,1]=4 338 B13R1.35 CC(C)Nc1ccc(c(c1)Cl)C=O e4e23402a6135a41cc824293c11a14d3 [0,1,0,0,0,1|0,0,0]=2 339 B13R1.35 CC(C)Nc1ccc(c(c1)Cl)CO eeaa0d20fcb2b33d0c77fbbedd8c92e8 [0,1,0,0,0,1|0,0,2]=4 340 B13R1.35 CC(C)Nc1ccc(c(c1)F)C#N 5ebc5cfe94ca350d397792831f72bc3a [0,1,0,0,0,1|1,0,1]=4 341 B13R1.35 CC(C)Nc1ccc(c(c1)F)C=O 38090b9fcedf66bb2d617d1ae6387ee7 [0,1,0,0,0,1|0,0,0]=2 342 B13R1.35 CC(C)Nc1ccc(c(c1)F)CO 66aac16884f4b216c0083910a8082994 [0,1,0,0,0,1|0,0,2]=4 343 B13R1.35 CC(C)Nc1ccc(c(c1)I)CO d5bc6e04eed458356c45da29335ea832 [0,1,0,0,0,1|0,0,2]=4 344 B13R1.35 CC(C)Nc1ncc(c(=O)[nH]1)C=O 247bdabb2cd6e8cb59a802def5c52c13 [0,1,0,0,0,1|2,0,0]=4 345 B13R1.35 CC(C)Nc1ncc(c(n1)Cl)C=O 723b6da711b7c644d204e40a91494dc6 [0,1,0,0,0,1|2,0,0]=4 346 B13R1.35 CC(C)Oc1ccc(c(c1)Br)C#N 9d5e645c828a972dead1821dd440f539 [0,1,0,0,0,1|1,0,1]=4 347 B13R1.35 CC(C)Oc1ccc(c(c1)Br)C=O e51e74b89dfb55029db396b67562c0bf [0,1,0,0,0,1|0,0,0]=2 348 B13R1.35 CC(C)Oc1ccc(c(c1)Cl)C#N 4957733549566499dcc1c727dd492c62 [0,1,0,0,0,1|1,0,1]=4 349 B13R1.35 CC(C)Oc1ccc(c(c1)Cl)C=O 9fdd1dab7c1c6459411982c7e183b122 [0,1,0,0,0,1|0,0,0]=2 350 B13R1.35 CC(C)Oc1ccc(c(c1)F)C#N fbdfa35a1ccf532405628ecaac766130 [0,1,0,0,0,1|1,0,1]=4 351 B13R1.35 CC(C)Oc1ccc(c(c1)F)C=O b00531201679ce19e9505d4432789f84 [0,1,0,0,0,1|0,0,0]=2 352 B13R1.35 CC(C)Oc1ccc(c(c1)I)C#N e146a5f74519537bb4a2d5e983af21a2 [0,1,0,0,0,1|1,0,1]=4 353 B13R1.35 CC(C)Oc1ccc(c(c1)I)C=O d9c903ac8f2abf2f5fc00c6af4444a2c [0,1,0,0,0,1|0,0,0]=2 354 B13R1.35 CC(C)Oc1cnc(c(c1)Cl)C=O deffc2b409f64282c17d4a2b4d4628d3 [0,1,0,0,0,1|1,0,0]=3 355 B13R1.35 CC(C)Oc1cnc(c(c1)F)C=O 8133a2b6df1cf536c55c1fe98bef9c0d [0,1,0,0,0,1|1,0,0]=3 356 B13R1.35 CCc1ccc(cc1Br)OC(C)C 7e97c9d0b09a16e162ce7ca8f2105660 [0,1,0,0,0,1|1,0,1]=4 357 B13R1.35 CCc1ccc(cc1Cl)NC(C)C e60121392396a25de6076557e9139205 [0,1,0,0,0,1|1,0,1]=4 358 B13R1.35 CCc1ccc(cc1Cl)OC(C)C abb696736a58ee0122e8171f1a00ddf6 [0,1,0,0,0,1|1,0,1]=4 359 B13R1.35 CCc1ccc(cc1F)OC(C)C f7681f79fefefa734a5b6de3bc918d8f [0,1,0,0,0,1|1,0,1]=4 360 B13R1.35 COc1ccc(cc1Br)NC(C)C ffa1c8426f042abe15df19739b7cb0dc [0,1,0,0,0,1|2,0,0]=4 361 B13R1.35 COc1ccc(cc1Br)OC(C)C e832a7b8bb3dfedf5f650da534fd39ee [0,1,0,0,0,1|2,0,0]=4 362 B13R1.35 COc1ccc(cc1C)NC(C)C 468b3e96e87a549b7fb5c5316ba65224 [0,1,0,0,0,1|2,0,0]=4 363 B13R1.35 COc1ccc(cc1C)OC(C)C 055e24233ac66389767b1cbea9d885ac [0,1,0,0,0,1|2,0,0]=4 364 B13R1.35 COc1ccc(cc1Cl)NC(C)C ccd44488d6499f8e66ad0327d516b4fc [0,1,0,0,0,1|2,0,0]=4 365 B13R1.35 COc1ccc(cc1Cl)OC(C)C 3740d3d1689d24ec02a9295481eab237 [0,1,0,0,0,1|2,0,0]=4 366 B13R1.35 COc1ccc(cc1F)NC(C)C 2590fb13f10910483b6298f484713743 [0,1,0,0,0,1|2,0,0]=4 367 B13R1.35 COc1ccc(cc1F)OC(C)C 6d62b6bae5c494ca4e3a8b996af5fe4f [0,1,0,0,0,1|2,0,0]=4 368 B13R1.35 COc1ccc(cc1I)NC(C)C c29b7745832574a4d3f3db30ebeed38a [0,1,0,0,0,1|2,0,0]=4 369 B13R1.35 COc1ccc(cc1I)OC(C)C 3691e2a73c49417af8d92514921af6bc [0,1,0,0,0,1|2,0,0]=4 370 B13R1.35 CSc1ccc(cc1C)OC(C)C 635d586b3692f565533c5f13f02d1479 [0,1,0,0,0,1|2,0,0]=4 371 B13R1.35 CSc1ccc(cc1Cl)NC(C)C 95a0bbc4676be55ff53ec744ae0ac5f9 [0,1,0,0,0,1|2,0,0]=4 372 B13R1.35 CSc1ccc(cc1Cl)OC(C)C 260abdb08ee65d7fac5ecd9095c71950 [0,1,0,0,0,1|2,0,0]=4 373 B13R1.35 CSc1ccc(cc1F)NC(C)C 3acc5bf7393d358f629574b866dd1816 [0,1,0,0,0,1|2,0,0]=4 374 B13R1.35 CSc1ccc(cc1F)OC(C)C bcf9818831dbf971971550e96c3a87c4 [0,1,0,0,0,1|2,0,0]=4 375 B13R1.35 Cc1cc(ccc1C#N)NC(C)C 1ad9d52eb67b03c991ac46c74eb10f04 [0,1,0,0,0,1|1,0,1]=4 376 B13R1.35 Cc1cc(ccc1C#N)OC(C)C 62d6d7c94f79d245832cea3ddad118ca [0,1,0,0,0,1|1,0,1]=4 377 B13R1.35 Cc1cc(ccc1C=O)OC(C)C cf6b6d9f68b680c6f011df2b61d640e2 [0,1,0,0,0,1|0,0,0]=2 378 B13R1.35 Cc1cc(ccc1CO)NC(C)C f9f58008a7def8c792faaa4e1681352b [0,1,0,0,0,1|0,0,2]=4 379 B13R1.35 Cc1nc(ccc1C=O)NC(C)C 3743f37890e3574adeb831be3cd90e71 [0,1,0,0,0,1|1,0,0]=3 380 B13R1.35 Cc1nc(ncc1C=O)NC(C)C 3eecda436b5c3d73cf0a8e064a4480f2 [0,1,0,0,0,1|2,0,0]=4 381 B13R1.36 C=Cc1ccc(cn1)N(C)C(C)C a4c9b8e525ff415dc7034adb5f75a682 [0,1,0,0,0,1|2,0,0]=4 382 B13R1.36 CC(=O)N(C)c1ccc(cc1)C=O 7b934dc58f2646cd1de1c9703ec3899a [0,1,0,0,0,1|1,0,1]=4 383 B13R1.36 CC(C)N(C)c1ccc(cc1)C=O b62ec8de5e20606c86aad19349101009 [0,1,0,0,0,1|0,0,0]=2 384 B13R1.36 CC(C)N(C)c1ccc(cc1)CO d63cbee63b30b1aef8ea7a60333b25c0 [0,1,0,0,0,1|0,0,2]=4 385 B13R1.36 CC(C)N(C)c1ccc(cn1)C=O b496188bc1d8a518d3b093cf7d6e90dd [0,1,0,0,0,1|1,0,0]=3 386 B13R1.142 C#CCc1ccc(cc1)OC(C)C 8f7745f7f417b79ebc65a462cd8c0c30 [0,1,0,0,0,1|1,0,1]=4 387 B13R1.142 C=CCc1ccc(cc1)NC(C)C 150a0aef084900ec4673ee087ed2e67b [0,1,0,0,0,1|1,0,0]=3 388 B13R1.142 C=CCc1ccc(cc1)OC(C)C 3a71c55c68ad055ac37b7f8428d0ee4b [0,1,0,0,0,1|1,0,0]=3 389 B13R1.142 CC(=O)Nc1ccc(cc1)NC=O 2da5e7c4f6220f06cee92b6901fb3591 [0,1,0,0,0,1|1,0,1]=4 390 B13R1.142 CC(=O)Oc1ccc(cc1)NC=O 0f6f6072577684bbba1317e30b3d0d36 [0,1,0,0,0,1|1,0,1]=4 391 B13R1.142 CC(C)Cc1ccc(cc1)NC=O 6f95e18e8457f75b73cae377e3af8826 [0,1,0,0,0,1|0,0,0]=2 392 B13R1.142 CC(C)Cc1ccc(cc1)NCF ab69b5185b87a6b4e51f5419bc46e48f [0,1,0,0,0,1|1,0,1]=4 393 B13R1.142 CC(C)Cc1ccc(cc1)NCO 7653bbefa45a749a2dd45d430f6af0e7 [0,1,0,0,0,1|0,0,2]=4 394 B13R1.142 CC(C)Cc1ccc(cc1)OCF c114182aa7f5220f6361154ae9d4f383 [0,1,0,0,0,1|1,0,1]=4 395 B13R1.142 CC(C)Cc1ccc(cn1)NC=O 1c711e6f0846c79a0767f5f80d8319e7 [0,1,0,0,0,1|1,0,0]=3 396 B13R1.142 CC(C)Nc1ccc(cc1)CC#N c4ac5eb00c2b9c6d0624d9ccbafbf5b1 [0,1,0,0,0,1|1,0,1]=4 397 B13R1.142 CC(C)Nc1ccc(cc1)CCBr 7a1c08ff4e9f4974300610d6ff545ee3 [0,1,0,0,0,1|1,0,1]=4 398 B13R1.142 CC(C)Nc1ccc(cc1)CCO 0191d51fdf89e18d4d726fd0173bc10b [0,1,0,0,0,1|0,0,2]=4 399 B13R1.142 CC(C)Nc1ccc(cc1)OCF 73dfe53380004446208b7599c87ca69d [0,1,0,0,0,1|1,0,1]=4 400 B13R1.142 CC(C)Nc1ccc(cc1)SC#N 60ddd030ef7bf6a85ea0cbf28c44b096 [0,1,0,0,0,1|1,0,1]=4 401 B13R1.142 CC(C)Oc1ccc(cc1)CC#N 7e03789b89a6cef1afba62c576d936c1 [0,1,0,0,0,1|1,0,1]=4 402 B13R1.142 CC(C)Oc1ccc(cc1)CC=O 7a881167b9a5cefb9bc2f1d31711b1eb [0,1,0,0,0,1|0,0,0]=2 403 B13R1.142 CC(C)Oc1ccc(cc1)CCF 7096172ff5af6afdf261ea5a1fa89879 [0,1,0,0,0,1|1,0,1]=4 404 B13R1.142 CC(C)Oc1ccc(cc1)NC=O 870d56a770d2133a3be35423113a25f2 [0,1,0,0,0,1|0,0,0]=2 405 B13R1.142 CC(C)Oc1ccc(cc1)NCF f7f6ad53c2efeb9922b9a3ef72982a6d [0,1,0,0,0,1|1,0,1]=4 406 B13R1.142 CC(C)Oc1ccc(cc1)NCO 96662adb2ddf4d45cd7379a7b6f96792 [0,1,0,0,0,1|0,0,2]=4 407 B13R1.142 CC(C)Oc1ccc(cc1)OCF 17130c347d069aeaf7cb1bc92c7bd5ff [0,1,0,0,0,1|1,0,1]=4 408 B13R1.142 CC(C)Oc1ccc(cn1)NC=O d8e829f97d323d8ebff6a7f6bac9ba9a [0,1,0,0,0,1|1,0,0]=3 409 B13R1.142 CC(C)Oc1ccc(nn1)NC=O 117e35e44261eba275abc24262f3c43f [0,1,0,0,0,1|2,0,0]=4 410 B13R1.142 CC(C)Oc1cnc(cn1)NC=O c46244290df40b9616ce895401c3bd9f [0,1,0,0,0,1|2,0,0]=4 411 B13R1.142 CC(C)Sc1ccc(cc1)NC=O 3ef6e989b65ccc2925cc6eae7b1d3af6 [0,1,0,0,0,1|0,0,0]=2 412 B13R1.142 CC(C)Sc1ccc(cc1)NCF 8c15a3ed999952bceb5d33aa53c5136d [0,1,0,0,0,1|1,0,1]=4 413 B13R1.142 CC(C)Sc1ccc(cc1)NCO 5cfc6837cd2b41194bf87df90f995ed5 [0,1,0,0,0,1|0,0,2]=4 414 B13R1.142 CC(C)Sc1ccc(cc1)OCF 1a1069032f6feda8ff779b69a150f768 [0,1,0,0,0,1|1,0,1]=4 415 B13R1.142 CCCc1ccc(cc1)NC(C)C cfa805e7544b211aa926dbf36a319dd3 [0,1,0,0,0,1|1,0,1]=4 416 B13R1.142 CCCc1ccc(cc1)OC(C)C 456d070db70f39855797de72245dce56 [0,1,0,0,0,1|1,0,1]=4 417 B13R1.142 CCNc1ccc(cc1)CC(C)C 86b6be64526d0c8d72ae0ab36e27d97b [0,1,0,0,0,1|1,0,1]=4 418 B13R1.142 CCNc1ccc(cc1)OC(C)C 9791d81b2fa341c94a8c984588454d38 [0,1,0,0,0,1|1,0,1]=4 419 B13R1.142 CCNc1ccc(cc1)SC(C)C e21e0088396d17e87e59100af4738d15 [0,1,0,0,0,1|1,0,1]=4 420 B13R1.142 CCOc1ccc(cc1)CC(C)C 12bb2357add226cea404f6c015341b41 [0,1,0,0,0,1|1,0,1]=4 421 B13R1.142 CCOc1ccc(cc1)NC(C)C 8e32b1ed9cae08d9f5404617754d4b2c [0,1,0,0,0,1|1,0,1]=4 422 B13R1.142 CCOc1ccc(cc1)OC(C)C 52e1c0a1919664bde0184c4037267ce4 [0,1,0,0,0,1|1,0,1]=4 423 B13R1.142 CCOc1ccc(cc1)SC(C)C 066a078e41bc3d45546bd1bead96dab8 [0,1,0,0,0,1|1,0,1]=4 424 B13R1.142 CCSc1ccc(cc1)OC(C)C 433c3420cec1e27fbdb9eeda0da9d2b4 [0,1,0,0,0,1|1,0,1]=4 425 B13R1.142 CN(C)Cc1ccc(cc1)NC=O 6a608d4ce9c61c62a58e0f6ca9979874 [0,1,0,0,0,1|1,0,0]=3 426 B13R1.142 CN(C)Cc1ccc(nc1)NC=O c37dedac4d4550ad65f9a531f6803b83 [0,1,0,0,0,1|2,0,0]=4 427 B13R1.142 COCc1ccc(cc1)NC(C)C 68b3a7da684fdcd1b1cd162a48628d85 [0,1,0,0,0,1|0,0,2]=4 428 B13R1.142 COCc1ccc(cc1)OC(C)C 5e6673597bdea662dc01f24ee4fc10dc [0,1,0,0,0,1|0,0,2]=4 429 B13R1.142 CSCc1ccc(cc1)NC(C)C b714bdf1845873a6f4efee1d2cfb363c [0,1,0,0,0,1|0,1,1]=4 430 B13R1.142 O=CNc1ccc(cc1)CC(F)F e6274302b314e4a9927d47dda9929914 [0,1,0,0,0,1|2,0,0]=4 431 B13R1.142 O=CNc1ccc(cc1)OC(F)F e7ed5030b4b4d1840a8db88251fb39cf [0,1,0,0,0,1|2,0,0]=4 432 B13R1.142 O=CNc1ccc(cc1)SC(F)F 97c1d062bc869f1b97dc545697da133d [0,1,0,0,0,1|2,0,0]=4 433 B13R1.585 C=C(C)c1ccc(cc1)OC(C)C c728777fa1e53559069851fad769b63a [0,1,0,0,0,1|1,0,0]=3 434 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C 32caac7d87eeae7a025e3ee6687b2850 [0,1,0,0,0,1|1,0,1]=4 435 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N a222e9a1c0783b453c0ec254a85faf87 [0,1,0,0,0,1|1,0,1]=4 436 B13R1.585 CC(=O)c1ccc(cc1)NC(C)C 8b5a780fbf36f9b7308bb2274dc9115c [0,1,0,0,0,1|0,0,0]=2 437 B13R1.585 CC(=O)c1ccc(cc1)OC(C)C 9071a26d99745e5c4ccc5deee6daf818 [0,1,0,0,0,1|0,0,0]=2 438 B13R1.585 CC(=O)c1ccc(cn1)NC(C)C f92639c5e8d19efde4bb0c21cfbc1fef [0,1,0,0,0,1|1,0,0]=3 439 B13R1.585 CC(=O)c1ccc(cn1)OC(C)C 9bf89bae95374ff2ad464e9d43ea0328 [0,1,0,0,0,1|1,0,0]=3 440 B13R1.585 CC(=O)c1ccc(nc1)NC(C)C d185f5692458b18ea5e311a5c1c0eaa2 [0,1,0,0,0,1|1,0,0]=3 441 B13R1.585 CC(=O)c1ccc(nc1)OC(C)C c69bb0e5373fe76b3709bfa892a2bdc3 [0,1,0,0,0,1|1,0,0]=3 442 B13R1.585 CC(=O)c1cnc(cn1)NC(C)C 738abb98096085d4d80f1e0d6ed46abf [0,1,0,0,0,1|2,0,0]=4 443 B13R1.585 CC(=O)c1cnc(cn1)OC(C)C 6ce166006114f4cec16b05e726fb2157 [0,1,0,0,0,1|2,0,0]=4 444 B13R1.585 CC(=O)c1cnc(nc1)NC(C)C 759a139d6e19bb28a90885fcaa983965 [0,1,0,0,0,1|2,0,0]=4 445 B13R1.585 CC(=O)c1cnc(nc1)OC(C)C 7b57ad7b5b8e1417510eb91027ca532c [0,1,0,0,0,1|2,0,0]=4 446 B13R1.585 CC(C)Nc1ccc(cc1)C(=O)N 6f573655090a284632e32e0fa95476fd [0,1,0,0,0,1|0,0,0]=2 447 B13R1.585 CC(C)Nc1ccc(cc1)C(=O)O 4412f684aaca0b8495291f0590a3ef57 [0,1,0,0,0,1|0,0,0]=2 448 B13R1.585 CC(C)Nc1ccc(cc1)C(=S)N 5eb15e675b982e83b6a6d68889443219 [0,1,0,0,0,1|0,1,0]=3 449 B13R1.585 CC(C)Nc1ccc(cc1)C(C)C 89b2a462e2c5ecc1be668f6436f410f7 [0,1,0,0,0,1|1,0,1]=4 450 B13R1.585 CC(C)Nc1ccc(cc1)C(C)O 96de7766f8821412133c1f1a8aa27a9e [0,1,0,0,0,1|0,0,2]=4 451 B13R1.585 CC(C)Nc1ccc(cc1)N(C)C 7d6ec150a99216d01ee95ec3c68c00bf [0,1,0,0,0,1|2,0,0]=4 452 B13R1.585 CC(C)Nc1ccc(cc1)S(=O)C 6558c429263532ec0e1fef84f81a83c0 [0,1,0,0,0,1|1,0,0]=3 453 B13R1.585 CC(C)Nc1ccc(cc1)[N+](=O)[O-] e9102099a9552ed4c6ead8b013a28107 [0,1,0,0,0,1|1,0,0]=3 454 B13R1.585 CC(C)Nc1ccc(cn1)C(=O)N 8e462f8771b04efc352d362b17e878f4 [0,1,0,0,0,1|1,0,0]=3 455 B13R1.585 CC(C)Nc1ccc(cn1)C(=O)O 87da24ff5008d49798633fb0047d8dfe [0,1,0,0,0,1|1,0,0]=3 456 B13R1.585 CC(C)Nc1ccc(cn1)[N+](=O)[O-] 736e5fde5d58a50bfb1cb0db7da3ccdf [0,1,0,0,0,1|2,0,0]=4 457 B13R1.585 CC(C)Nc1ccc(nc1)C(=O)N b1facd0a4df06442688fce47ba60c97e [0,1,0,0,0,1|1,0,0]=3 458 B13R1.585 CC(C)Nc1ccc(nc1)C(=O)O 37ae459c40e25e4d238272630a4926f5 [0,1,0,0,0,1|1,0,0]=3 459 B13R1.585 CC(C)Nc1ccc(nc1)C(=S)N ae7aa1e629613fa12c7d5581135f2a1d [0,1,0,0,0,1|1,1,0]=4 460 B13R1.585 CC(C)Nc1ccc(nc1)[N+](=O)[O-] 945ef3e5988bd11eb39e5347d797f9f7 [0,1,0,0,0,1|2,0,0]=4 461 B13R1.585 CC(C)Nc1ccc(nn1)C(=O)N 068d9b899b26586fc15cc97de0fc3239 [0,1,0,0,0,1|2,0,0]=4 462 B13R1.585 CC(C)Nc1ccc(nn1)C(=O)O 635b882fc5a311292012e03e53315576 [0,1,0,0,0,1|2,0,0]=4 463 B13R1.585 CC(C)Nc1cnc(cn1)C(=O)N ee00d41e9239a38e4e781e84fe6a3a9c [0,1,0,0,0,1|2,0,0]=4 464 B13R1.585 CC(C)Nc1cnc(cn1)C(=O)O 5132f3c1f139402ae2ed80d3bb421b9e [0,1,0,0,0,1|2,0,0]=4 465 B13R1.585 CC(C)Nc1cnc(nc1)C(=O)N dfd47de7037a91bd9667fa8ecae3dcc1 [0,1,0,0,0,1|2,0,0]=4 466 B13R1.585 CC(C)Nc1cnc(nc1)C(=O)O f955add6ec766da8326f5e0eeed3c126 [0,1,0,0,0,1|2,0,0]=4 467 B13R1.585 CC(C)Nc1ncc(cn1)C(=O)O 13eca1a6218147d2ffaff6c623919b6c [0,1,0,0,0,1|2,0,0]=4 468 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)N 5814f45e55462d66647a1e933127e05e [0,1,0,0,0,1|0,0,0]=2 469 B13R1.585 CC(C)Oc1ccc(cc1)C(=O)O c6a3ac8fa0820ca9cc9b091b9908ef0c [0,1,0,0,0,1|0,0,0]=2 470 B13R1.585 CC(C)Oc1ccc(cc1)C(=S)N a980845b58448d069ac8e85e6bfa3f81 [0,1,0,0,0,1|0,1,0]=3 471 B13R1.585 CC(C)Oc1ccc(cc1)C(C)C cc289477fa7eab9044cd1fe112276acb [0,1,0,0,0,1|1,0,1]=4 472 B13R1.585 CC(C)Oc1ccc(cc1)N(C)C fb89af93f45b678443442fddbc50d8f8 [0,1,0,0,0,1|2,0,0]=4 473 B13R1.585 CC(C)Oc1ccc(cc1)S(=O)C c3cc33fb9cf73645aba52a834c952a14 [0,1,0,0,0,1|1,0,0]=3 474 B13R1.585 CC(C)Oc1ccc(cc1)[N+](=O)[O-] 54280527fc0f4565ec1a61689a02170f [0,1,0,0,0,1|1,0,0]=3 475 B13R1.585 CC(C)Oc1ccc(cn1)C(=O)N b7c8031ea0997f151736383638482118 [0,1,0,0,0,1|1,0,0]=3 476 B13R1.585 CC(C)Oc1ccc(cn1)C(=O)O 5128db23b921055c2482428b61dd3830 [0,1,0,0,0,1|1,0,0]=3 477 B13R1.585 CC(C)Oc1ccc(cn1)C(=S)N 021289e44589ad9271b8b58f87bcd4f4 [0,1,0,0,0,1|1,1,0]=4 478 B13R1.585 CC(C)Oc1ccc(nc1)C(=O)N 740139f464015edebbce62189f3465ff [0,1,0,0,0,1|1,0,0]=3 479 B13R1.585 CC(C)Oc1ccc(nc1)C(=O)O 251a0f9c8731e8aa9a7b4522b73aa429 [0,1,0,0,0,1|1,0,0]=3 480 B13R1.585 CC(C)Oc1ccc(nc1)[N+](=O)[O-] f52bf464d63e84a3484d20c0c2de736f [0,1,0,0,0,1|2,0,0]=4 481 B13R1.585 CC(C)Oc1cnc(cn1)C(=O)N 7c1ca8f802200d5efeba18a5cc01533b [0,1,0,0,0,1|2,0,0]=4 482 B13R1.585 CC(C)Oc1cnc(cn1)C(=O)O 02245091ec57badc834fe23354e636ba [0,1,0,0,0,1|2,0,0]=4 483 B13R1.585 CC(C)Oc1cnc(nc1)C(=O)O 1c07d8509a445843ec6d2db7bd2ffc96 [0,1,0,0,0,1|2,0,0]=4 484 B13R1.585 CC(C)Oc1ncc(cn1)C(=O)N 044319839e0e9d6ef7c43dd59a1b7847 [0,1,0,0,0,1|2,0,0]=4 485 B13R1.585 CC(C)Oc1ncc(cn1)C(=O)O 26fad88a82f8a403415830abaf697849 [0,1,0,0,0,1|2,0,0]=4 486 B13R1.653 C#Cc1ccc(c(c1)C)NC(C)C 795084d64c095e53213c0ba40b6608d1 [0,1,0,0,0,1|1,0,1]=4 487 B13R1.653 C#Cc1ccc(c(c1)Cl)NC(C)C 7e73651e7cb2e1b621a2a65cd56597fd [0,1,0,0,0,1|1,0,1]=4 488 B13R1.653 C#Cc1ccc(c(c1)F)NC(C)C 4747748644e98ebe85b814ccfc77c509 [0,1,0,0,0,1|1,0,1]=4 489 B13R1.653 C=Cc1ccc(c(c1)I)OC(C)C 0007d670a4f8e00ddeea575bc6df3dc5 [0,1,0,0,0,1|1,0,0]=3 490 B13R1.653 CC(C)Nc1ccc(cc1Br)C#N 4107597fd215d979feddd0342a4d9b47 [0,1,0,0,0,1|1,0,1]=4 491 B13R1.653 CC(C)Nc1ccc(cc1Br)C=O e5574b9a0fb12f0d5146b27ecd8ca5f7 [0,1,0,0,0,1|0,0,0]=2 492 B13R1.653 CC(C)Nc1ccc(cc1Cl)C#N 6c724bd40fa53cf82b7d82c9c4057ba9 [0,1,0,0,0,1|1,0,1]=4 493 B13R1.653 CC(C)Nc1ccc(cc1Cl)CO 4d90dc69d64321f5504f7dd51e3b4292 [0,1,0,0,0,1|0,0,2]=4 494 B13R1.653 CC(C)Nc1ccc(cc1F)C#N a658905ea34085cbf3001aa26c077eb9 [0,1,0,0,0,1|1,0,1]=4 495 B13R1.653 CC(C)Nc1ccc(cc1F)CO 604fce23934638a37977f4983927d204 [0,1,0,0,0,1|0,0,2]=4 496 B13R1.653 CC(C)Nc1ccc(cc1I)C#N 83411fc0d1e57dbdaaa222b3798e4a3b [0,1,0,0,0,1|1,0,1]=4 497 B13R1.653 CC(C)Nc1ccc(cc1I)CO ed3d064c8e38f8a851283e29e58a7343 [0,1,0,0,0,1|0,0,2]=4 498 B13R1.653 CC(C)Nc1ncc(cc1Br)C=O 0685d7a48e3ee85400e90f178e47b71e [0,1,0,0,0,1|1,0,0]=3 499 B13R1.653 CC(C)Oc1ccc(cc1Br)C#N 2a0c186a6c63078f2aa6f8f969c66899 [0,1,0,0,0,1|1,0,1]=4 500 B13R1.653 CC(C)Oc1ccc(cc1Br)C=O 3e770723afbc4d7e474ab65f5d4c8b20 [0,1,0,0,0,1|0,0,0]=2 501 B13R1.653 CC(C)Oc1ccc(cc1Cl)C#N 1ca256db9aab6c5ea63ff9688e7e35f4 [0,1,0,0,0,1|1,0,1]=4 502 B13R1.653 CC(C)Oc1ccc(cc1Cl)C=O 37febb94e431edff552d57c61410d453 [0,1,0,0,0,1|0,0,0]=2 503 B13R1.653 CC(C)Oc1ccc(cc1F)C#N 0c40f9f04b68825ed0727332631b080e [0,1,0,0,0,1|1,0,1]=4 504 B13R1.653 CC(C)Oc1ccc(cc1F)C=O f57d9db301df7b84f3fc62ab0a2d1138 [0,1,0,0,0,1|0,0,0]=2 505 B13R1.653 CC(C)Oc1ccc(cc1I)C#N b56428989b7669b73941eea281f1a4f8 [0,1,0,0,0,1|1,0,1]=4 506 B13R1.653 CC(C)Oc1ccc(cc1I)C=O 26c13058618a9f21e8b24436ef1e7290 [0,1,0,0,0,1|0,0,0]=2 507 B13R1.653 CC(C)Oc1ccc(nc1Br)C=O 30b22938aa20b0cafb20aabcf5fca008 [0,1,0,0,0,1|1,0,0]=3 508 B13R1.653 CC(C)Oc1ncc(cc1Cl)C=O 4c6a5c39c143c9147f4e5d3e7d2b5f38 [0,1,0,0,0,1|1,0,0]=3 509 B13R1.653 CC(C)Oc1ncc(cc1F)C=O 819e7992f7d8c12723a39fc311c8ec20 [0,1,0,0,0,1|1,0,0]=3 510 B13R1.653 CCc1ccc(c(c1)Br)NC(C)C b5797c70fb961357ff44ce362343ec33 [0,1,0,0,0,1|1,0,1]=4 511 B13R1.653 CCc1ccc(c(c1)Br)OC(C)C a24062e92feedbcdabf0d098610dbd22 [0,1,0,0,0,1|1,0,1]=4 512 B13R1.653 CCc1ccc(c(c1)C)NC(C)C 80e09cdcf033d231e53341b2bdb3049f [0,1,0,0,0,1|1,0,1]=4 513 B13R1.653 CCc1ccc(c(c1)C)OC(C)C d5e74939a165f369b782f2804d64c8ce [0,1,0,0,0,1|1,0,1]=4 514 B13R1.653 CCc1ccc(c(c1)Cl)NC(C)C 82f48f79d5784fd306c7ed1b629a4aaa [0,1,0,0,0,1|1,0,1]=4 515 B13R1.653 CCc1ccc(c(c1)Cl)OC(C)C fbf5e5282ae63bafa88bbcb272902492 [0,1,0,0,0,1|1,0,1]=4 516 B13R1.653 CCc1ccc(c(c1)F)NC(C)C 14b3f9bc30469d1dc3ac9253754d7889 [0,1,0,0,0,1|1,0,1]=4 517 B13R1.653 CCc1ccc(c(c1)I)NC(C)C 581a6495c162dba30fc33d65ee4c6274 [0,1,0,0,0,1|1,0,1]=4 518 B13R1.653 COc1ccc(c(c1)Br)OC(C)C 3625f3b539b35298743d3daed8e904df [0,1,0,0,0,1|2,0,0]=4 519 B13R1.653 COc1ccc(c(c1)C)NC(C)C 4866ba679ef6e070767c096dac4d4c57 [0,1,0,0,0,1|2,0,0]=4 520 B13R1.653 COc1ccc(c(c1)C)OC(C)C df1cbf72a86fed3dc3f5527d9c956941 [0,1,0,0,0,1|2,0,0]=4 521 B13R1.653 COc1ccc(c(c1)Cl)NC(C)C fa28add5fb89e578009cc5806b11b08a [0,1,0,0,0,1|2,0,0]=4 522 B13R1.653 COc1ccc(c(c1)Cl)OC(C)C 5b71e99a5df2a6833b0e50191780e832 [0,1,0,0,0,1|2,0,0]=4 523 B13R1.653 COc1ccc(c(c1)F)NC(C)C df6adf21eba014ed94d20329b92cc000 [0,1,0,0,0,1|2,0,0]=4 524 B13R1.653 COc1ccc(c(c1)F)OC(C)C afe4fffe1ec014ae2d5af09dbb1ca8f3 [0,1,0,0,0,1|2,0,0]=4 525 B13R1.653 COc1ccc(c(c1)I)NC(C)C 151119e2187aaf57ecf5ffae671830b2 [0,1,0,0,0,1|2,0,0]=4 526 B13R1.653 COc1ccc(c(c1)I)OC(C)C 92586f7b711b01edffce3689b01fc6e7 [0,1,0,0,0,1|2,0,0]=4 527 B13R1.653 COc1ccc(c(c1)S)NC(C)C db01971fb0516bb573bb77cbd1aa976d [0,1,0,0,0,1|2,0,0]=4 528 B13R1.653 CSc1ccc(c(c1)Br)OC(C)C 170108f3f325c3f404245da545f0a1bd [0,1,0,0,0,1|2,0,0]=4 529 B13R1.653 CSc1ccc(c(c1)C)OC(C)C a51a5347df3e79bb7c166bd4b6cb9b5f [0,1,0,0,0,1|2,0,0]=4 530 B13R1.653 Cc1cc(ccc1NC(C)C)C#N 9eaf7de349112578bfd01551f0de20ca [0,1,0,0,0,1|1,0,1]=4 531 B13R1.653 Cc1cc(ccc1NC(C)C)CO cf8535b4c59e8d9b86f5a943789fd707 [0,1,0,0,0,1|0,0,2]=4 532 B13R1.653 Cc1cc(ccc1OC(C)C)C#N f3e5e5b0d531d4477512a399fd58c4ca [0,1,0,0,0,1|1,0,1]=4 533 B13R1.653 Cc1cc(ccc1OC(C)C)C=O 401734b2b6f1e125cd9e3dda0b740baa [0,1,0,0,0,1|0,0,0]=2 534 B13R1.653 Cc1cc(cnc1OC(C)C)C=O 2bab23c94fad37efafc41da9f75db4d0 [0,1,0,0,0,1|1,0,0]=3 535 B13R1.653 Cc1nc(ccc1NC(C)C)C=O acad65af32350999a0fa7ca1816eea07 [0,1,0,0,0,1|1,0,0]=3 536 B13R1.39 CCN(C=O)c1ccc(cc1)C=O b6365f4a31c0c825d8d8133ed4c134fd [0,2,0,0,0,0|1,0,1]=4 537 B13R1.39 CCN(CC)c1ccc(cc1)C=O 2281a7a5cb89df1fa6fc3ed67b0a85c2 [0,2,0,0,0,0|1,0,0]=3 538 B13R1.39 CCN(CF)c1ccc(cc1)C=O 0981dffde89d4b0aeb5d10a7b26f399a [0,2,0,0,0,0|1,0,0]=3 539 B13R1.39 CCN(CO)c1ccc(cc1)C=O af84571339b59042caa7ad748504fa93 [0,2,0,0,0,0|1,0,0]=3 540 B13R1.95 CCN(C)c1ccc(cc1Br)C=O ee79383356f074ce164b1f426c65fca8 [0,2,0,0,0,0|1,0,0]=3 541 B13R1.95 CCN(C)c1ncc(cc1C)C=O a2e120128e8b90182077c5c38cc679ce [0,2,0,0,0,0|2,0,0]=4 542 B13R1.95 CN(CF)c1ccc(cc1Br)C=O 34169e05ceef23705a34bc6c995f73b1 [0,2,0,0,0,0|1,0,0]=3 543 B13R1.95 CN(CO)c1ccc(cc1Br)C=O 264f3e52f9db4a07922970f20be34ccc [0,2,0,0,0,0|1,0,0]=3 544 B13R1.139 C=CCc1ccc(cc1)N(C)CC 3d44ff8d4301be67039c294fe1287124 [0,2,0,0,0,0|2,0,0]=4 545 B13R1.139 CC(C#N)c1ccc(cc1)NC=O 2dfc8f944867984a4abb9cf7eb504c83 [0,2,0,0,0,0|0,0,1]=3 546 B13R1.139 CCC(=O)c1ccc(cc1)NC=O 17c7e1a4143492ea808f09b2097119a0 [0,2,0,0,0,0|1,0,1]=4 547 B13R1.139 CCC(C)c1ccc(cc1)NC=O 8a277943d5ff2f222bcc55b0949260d1 [0,2,0,0,0,0|0,0,0]=2 548 B13R1.139 CCC(C)c1ccc(cc1)OCF a7ec2fd5c3b4dfa79e743f12603d6954 [0,2,0,0,0,0|1,0,1]=4 549 B13R1.139 CCC(O)c1ccc(cc1)NC=O 02678ca23138722109e00d86e8d1e908 [0,2,0,0,0,0|1,0,0]=3 550 B13R1.139 CCN(C)c1ccc(cc1)CC=O 0a297eaeabe34644163889baca984e0c [0,2,0,0,0,0|1,0,0]=3 551 B13R1.139 CCN(C)c1ccc(cc1)NC=O f8de714367d4e4baf8b80132fc618523 [0,2,0,0,0,0|1,0,0]=3 552 B13R1.139 CCOc1ccc(cc1)C(C)OC be3b3531e6fc70e14245bfd3ab41cb9f [0,2,0,0,0,0|1,0,1]=4 553 B13R1.139 CNC(=O)c1ccc(cc1)NC=O ee256b4df43d2b433117bef66fc4bf7a [0,2,0,0,0,0|1,0,1]=4 554 B13R1.139 COC(=O)c1ccc(cc1)NC=O a7f77b659cc95a724807a56763ed8c9e [0,2,0,0,0,0|1,0,1]=4 555 B13R1.139 COC(C)c1ccc(cc1)OCF 85d3d5779161ba9367ec507e162402be [0,2,0,0,0,0|1,0,1]=4 556 B13R1.139 O=CNc1ccc(cc1)C(=O)CBr 3fd457ac8c9dd82b4726d07e778e33d8 [0,2,0,0,0,0|1,0,1]=4 557 B13R1.139 O=CNc1ccc(cc1)C(=O)CCl 479336bd518c5403482f80358593ad90 [0,2,0,0,0,0|1,0,1]=4 558 B13R1.452 C#CCN(C)c1ccc(cc1)C=O ccac660af71eccfa66c0d9c530d44451 [0,2,0,0,0,0|1,0,0]=3 559 B13R1.452 C#CCN(C)c1ccc(cn1)C=O 3631d2a15617c2d10320e18fc1ba6dfc [0,2,0,0,0,0|2,0,0]=4 560 B13R1.452 C=CCN(C)c1ccc(cc1)C=O ccc23bd724df05e1979da936a351bcd3 [0,2,0,0,0,0|1,0,0]=3 561 B13R1.452 C=CCN(C)c1ccc(cn1)C=O bd92acc40d4e43e8d1f8454f0591866f [0,2,0,0,0,0|2,0,0]=4 562 B13R1.452 C=CCN(C)c1ccc(nc1)C=O 17aac0b211eac9cdd95e62e2689fc7e7 [0,2,0,0,0,0|2,0,0]=4 563 B13R1.452 C=Cc1ccc(cc1)C(C)NC=O 6c7b601a59a0fd716c063da4c430ad08 [0,2,0,0,0,0|1,0,1]=4 564 B13R1.452 C=Cc1ccc(cc1)C(C)NCC 0cd9191cb9a1385c8b0f6ef25a37a175 [0,2,0,0,0,0|1,0,0]=3 565 B13R1.452 C=Cc1ccc(cc1)C(C)NCF 788acc2f27bb1de6b36e9e78d3bd704a [0,2,0,0,0,0|1,0,0]=3 566 B13R1.452 C=Cc1ccc(cc1)C(C)NCO e1c488895b0abb38e5f850e0cbacece6 [0,2,0,0,0,0|1,0,0]=3 567 B13R1.452 C=Cc1ccc(cc1)[C@H](C)NC=O 0efdcee80e3043b847d30e708fe264e5 [0,2,0,0,0,0|1,0,1]=4 568 B13R1.452 C=Cc1ccc(cc1)[C@H](C)NCC b0873884040b39bbbafbe4d524f5243f [0,2,0,0,0,0|1,0,0]=3 569 B13R1.452 C=Cc1ccc(cc1)[C@H](C)NCF 11f3ff9920f66672b3c9db2ad1c4f34c [0,2,0,0,0,0|1,0,0]=3 570 B13R1.452 C=Cc1ccc(cc1)[C@H](C)NCO 208fe2d6192f651708f4d8eab7cdba31 [0,2,0,0,0,0|1,0,0]=3 571 B13R1.452 CC(NCF)c1ccc(cc1)C#N 058a2d7b1a4708f3b30879bac9d3d1d0 [0,2,0,0,0,0|1,0,1]=4 572 B13R1.452 CC(NCF)c1ccc(cc1)CO ce9d35e3481cee7b63bd65b822d025cf [0,2,0,0,0,0|0,0,2]=4 573 B13R1.452 CC(NCO)c1ccc(cc1)C#N af6a47d654af8566154e28d056a9f2fa [0,2,0,0,0,0|1,0,1]=4 574 B13R1.452 CC(NCO)c1ccc(cc1)CO df27bf0111b10d69739de31c4fee02bc [0,2,0,0,0,0|0,0,2]=4 575 B13R1.452 CC(OCF)c1ccc(cc1)C=O 487f62e83894318b3941bc3f2c1f7251 [0,2,0,0,0,0|0,0,0]=2 576 B13R1.452 CCCN(C)c1ccc(cc1)C=O 95f7ddcf7ee59738eac1bb14a5f0fc97 [0,2,0,0,0,0|1,0,0]=3 577 B13R1.452 CCCN(C)c1ccc(cn1)C=O b2a638f76203e5be0129769b64218684 [0,2,0,0,0,0|2,0,0]=4 578 B13R1.452 CCCN(C)c1ccc(nc1)C=O c53cc105d799ed31efbb407a18a272c6 [0,2,0,0,0,0|2,0,0]=4 579 B13R1.452 CCNC(C)c1ccc(cc1)C#N 994485fc30e38a405d9e555aacbd58c7 [0,2,0,0,0,0|1,0,1]=4 580 B13R1.452 CCNC(C)c1ccc(cc1)CO 88bb55d75f76db7940188ce87b92c500 [0,2,0,0,0,0|0,0,2]=4 581 B13R1.452 CCNC(C)c1ccc(cc1)OC 9a4ec247918389e85c4c9d31cf557c32 [0,2,0,0,0,0|2,0,0]=4 582 B13R1.452 CCN[C@@H](C)c1ccc(cc1)C#N 92aaeaebbabcb6758134f7498bfb8822 [0,2,0,0,0,0|1,0,1]=4 583 B13R1.452 CCN[C@@H](C)c1ccc(cc1)CO 7e12fd34b13c1c08c92498998d282034 [0,2,0,0,0,0|0,0,2]=4 584 B13R1.452 CCN[C@@H](C)c1ccc(cc1)OC be8a9016265958a935be29c84a12ecf7 [0,2,0,0,0,0|2,0,0]=4 585 B13R1.452 CCN[C@@H](C)c1ccc(cc1)SC 654b3cebaaca5308e214200820f725e3 [0,2,0,0,0,0|2,0,0]=4 586 B13R1.452 CCN[C@H](C)c1ccc(cc1)C#N 4eafc3b27a915c18a78e54c34f84d97a [0,2,0,0,0,0|1,0,1]=4 587 B13R1.452 CCN[C@H](C)c1ccc(cc1)CO 0c0a92a18d7e635d493993de19bed373 [0,2,0,0,0,0|0,0,2]=4 588 B13R1.452 CCN[C@H](C)c1ccc(cc1)OC d91de09678b239dd7f2635b1c33bed24 [0,2,0,0,0,0|2,0,0]=4 589 B13R1.452 CCN[C@H](C)c1ccc(cc1)SC 1d83c7e3b47dbb40ae0e88ca2593633b [0,2,0,0,0,0|2,0,0]=4 590 B13R1.452 CCOC(C)c1ccc(cc1)C=O f141ed3ceb43c71abad924b5a0888a12 [0,2,0,0,0,0|0,0,0]=2 591 B13R1.452 CCOC(C)c1ccc(cc1)CC 0d33c03219dfda06e5af4d3ca05e0c95 [0,2,0,0,0,0|1,0,1]=4 592 B13R1.452 CCOC(C)c1ccc(cc1)OC 6815227232f6d62e2adb1f96631f2865 [0,2,0,0,0,0|2,0,0]=4 593 B13R1.452 CCO[C@@H](C)c1ccc(cc1)OC bdcca3470d37aa2e7256815bdedf6a44 [0,2,0,0,0,0|2,0,0]=4 594 B13R1.452 CCO[C@H](C)c1ccc(cc1)OC b3e6053607f0fd5e6a1b84492611236d [0,2,0,0,0,0|2,0,0]=4 595 B13R1.452 CCc1ccc(cc1)C(C)OCF 9b2e4b399c18265b5d5205a0ba5e157a [0,2,0,0,0,0|1,0,1]=4 596 B13R1.452 CN(CC#N)c1ccc(cc1)C=O 673d95cc993480db06c6e51b14cd3370 [0,2,0,0,0,0|1,0,0]=3 597 B13R1.452 CN(CC#N)c1ccc(cn1)C=O 5e44773ee1899215a84f0c5c3bd3b049 [0,2,0,0,0,0|2,0,0]=4 598 B13R1.452 CN(CC#N)c1ccc(nc1)C=O ab9cf21a9825374fa0285975b2249b46 [0,2,0,0,0,0|2,0,0]=4 599 B13R1.452 CN(CC=O)c1ccc(cc1)C=O 4b77eb96066eb94f3bc84981b689c9d9 [0,2,0,0,0,0|1,0,0]=3 600 B13R1.452 CN(CC=O)c1ccc(cn1)C=O 81aac374a62d9f9fa847612b3168386c [0,2,0,0,0,0|2,0,0]=4 601 B13R1.452 CN(CCF)c1ccc(cc1)C=O 8cf392c949ca84ca031272bd66bc1c7e [0,2,0,0,0,0|1,0,0]=3 602 B13R1.452 CN(CCF)c1ccc(cn1)C=O a9655990c08f2702a9917e7873cec78f [0,2,0,0,0,0|2,0,0]=4 603 B13R1.452 CN(CCF)c1ccc(nc1)C=O 50eb40f965d8229fe1ffff3730c0490d [0,2,0,0,0,0|2,0,0]=4 604 B13R1.452 CN(CCO)c1ccc(cc1)C=O 9c96314f1c191c5e775b5f4eb84140ea [0,2,0,0,0,0|1,0,0]=3 605 B13R1.452 CN(CCO)c1ccc(cn1)C=O 48a16d1b0c97ea0f39ee35e119374e72 [0,2,0,0,0,0|2,0,0]=4 606 B13R1.452 CN(CCO)c1ccc(nc1)C=O a225c24960af16d42fed56b626c5bd7a [0,2,0,0,0,0|2,0,0]=4 607 B13R1.452 CN(CCS)c1ccc(cc1)C=O 67befcee12bc818f0918849da48ed7f1 [0,2,0,0,0,0|1,0,0]=3 608 B13R1.452 CN(CCS)c1ccc(cn1)C=O 58c749d15397cab56c17c6bf5d7de890 [0,2,0,0,0,0|2,0,0]=4 609 B13R1.452 COCN(C)c1ccc(cc1)C=O be2902ad9fc8f4b952a7f79a24627146 [0,2,0,0,0,0|1,0,0]=3 610 B13R1.452 COCN(C)c1ccc(cn1)C=O df142a68469ab69e22add4a9399d52e9 [0,2,0,0,0,0|2,0,0]=4 611 B13R1.452 COc1ccc(cc1)C(C)NCF a83bc4c9cad83ac805d78fe341a544ab [0,2,0,0,0,0|2,0,0]=4 612 B13R1.452 COc1ccc(cc1)C(C)NCO 7a5e094fc120ce1fcd472d52098a4776 [0,2,0,0,0,0|2,0,0]=4 613 B13R1.452 COc1ccc(cc1)C(C)OCF 74ca4a65b1d0d544c1b93e708ef79eac [0,2,0,0,0,0|2,0,0]=4 614 B13R1.452 COc1ccc(cc1)[C@@H](C)NCF 975879873644c7d0d63cc1e21504da10 [0,2,0,0,0,0|2,0,0]=4 615 B13R1.452 COc1ccc(cc1)[C@@H](C)NCO db38d244feb4988238d6515c7c61fd64 [0,2,0,0,0,0|2,0,0]=4 616 B13R1.452 COc1ccc(cc1)[C@@H](C)OCF 1f413372265094a34268fb31188c2b61 [0,2,0,0,0,0|2,0,0]=4 617 B13R1.452 COc1ccc(cc1)[C@H](C)NCF 5a1f1c0977912134d8ece0fa6fdc1f15 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.452 COc1ccc(cc1)[C@H](C)NCO 18a0494f682db88de11f449e4f27de19 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.452 COc1ccc(cc1)[C@H](C)OCF 2236302ecd398ed665aa735ad72bd989 [0,2,0,0,0,0|2,0,0]=4 620 B13R1.452 CSCN(C)c1ccc(cc1)C=O e59cedc7a1c9503d10c43a72209ed1b1 [0,2,0,0,0,0|1,0,0]=3 621 B13R1.452 CSCN(C)c1ccc(cn1)C=O 06fb919abadf03f11af067272d476d66 [0,2,0,0,0,0|2,0,0]=4 622 B13R1.452 CSc1ccc(cc1)[C@@H](C)NCF 56f06704d8572ff9118b376ca655bdaf [0,2,0,0,0,0|2,0,0]=4 623 B13R1.452 CSc1ccc(cc1)[C@@H](C)NCO 6d2a98ae6da88765a3e965691e17ab9b [0,2,0,0,0,0|2,0,0]=4 624 B13R1.452 CSc1ccc(cc1)[C@H](C)NCF b477ad50386d5d470b6a6c186c1290e2 [0,2,0,0,0,0|2,0,0]=4 625 B13R1.452 CSc1ccc(cc1)[C@H](C)NCO 25b979911c7709a1fa73e490afd16af0 [0,2,0,0,0,0|2,0,0]=4 626 B13R1.452 C[C@@H](NCF)c1ccc(cc1)C#N 5496fa5104d892aa3f518a89bb2107e9 [0,2,0,0,0,0|1,0,1]=4 627 B13R1.452 C[C@@H](NCF)c1ccc(cc1)CO 40bd84e6a8d7fda6d1e1881156d76848 [0,2,0,0,0,0|0,0,2]=4 628 B13R1.452 C[C@@H](NCO)c1ccc(cc1)C#N c69a274624a248f2ca61087c96f7a8e7 [0,2,0,0,0,0|1,0,1]=4 629 B13R1.452 C[C@@H](NCO)c1ccc(cc1)CO b2420d4c0c5137f692ddf6d61d9a55b3 [0,2,0,0,0,0|0,0,2]=4 630 B13R1.452 C[C@H](NCF)c1ccc(cc1)C#N 58118cbe585c08e6cfa3fd3bceba4174 [0,2,0,0,0,0|1,0,1]=4 631 B13R1.452 C[C@H](NCF)c1ccc(cc1)CO a8f1501e5e8fe77dc7a034bc57797e53 [0,2,0,0,0,0|0,0,2]=4 632 B13R1.452 C[C@H](NCO)c1ccc(cc1)C#N fe8ea6a5d18c1a8bb9e85a6fc6cd98f2 [0,2,0,0,0,0|1,0,1]=4 633 B13R1.452 C[C@H](NCO)c1ccc(cc1)CO 0b0e47d0c72b62068f765372f1a0a111 [0,2,0,0,0,0|0,0,2]=4 634 B13R1.537 CC(=O)c1ccc(cc1)N(C)C=O 48b14a45b70097568ca7f160e0b4be75 [0,2,0,0,0,0|1,0,1]=4 635 B13R1.537 CC(=O)c1ccc(cc1)N(C)CF efb2648ef079afbb9b48bc70d2551b3c [0,2,0,0,0,0|1,0,0]=3 636 B13R1.537 CC(=O)c1ccc(cc1)N(C)CO 5672554f1c5d29a42e173924a38ca34e [0,2,0,0,0,0|1,0,0]=3 637 B13R1.537 CC(=O)c1ccc(nc1)N(C)CF e89cea373314e8fc56679457f5bf1c7a [0,2,0,0,0,0|2,0,0]=4 638 B13R1.537 CC(=O)c1ccc(nc1)N(C)CO 69b10d624db0206309063d926efe92ce [0,2,0,0,0,0|2,0,0]=4 639 B13R1.537 CCN(C)c1ccc(cc1)C(=O)C 78ddd4c7fae1a16b1e2f19c51d9818c2 [0,2,0,0,0,0|1,0,0]=3 640 B13R1.537 CCN(C)c1ccc(cc1)C(=O)O 21baacd2bde08ec83bd2b5f9f42d5e2f [0,2,0,0,0,0|1,0,0]=3 641 B13R1.537 CCN(C)c1ccc(cc1)C(=S)N 501ff264f6a3982014ae15cd37cc8db5 [0,2,0,0,0,0|1,1,0]=4 642 B13R1.537 CCN(C)c1ccc(cn1)C(=O)C 757f4ba1694bcc0250570cd4080b33da [0,2,0,0,0,0|2,0,0]=4 643 B13R1.537 CCN(C)c1ccc(cn1)C(=O)N bca5312afbb61668b0ffac5d7be6847d [0,2,0,0,0,0|2,0,0]=4 644 B13R1.537 CCN(C)c1ccc(cn1)C(=O)O 22aa85ad68d4fb4ac9b18f2a821b3853 [0,2,0,0,0,0|2,0,0]=4 645 B13R1.537 CCN(C)c1ccc(nc1)C(=O)C 4231f20283769cf45bef52770431dbfc [0,2,0,0,0,0|2,0,0]=4 646 B13R1.537 CCN(C)c1ccc(nc1)C(=O)O 4e2ed161ba8295bef684bf7432848770 [0,2,0,0,0,0|2,0,0]=4 647 B13R1.537 CN(C)c1ccc(cc1)N(C)C=O c057ef4caa4da975b4d487eb6f85ba0a [0,2,0,0,0,0|1,0,0]=3 648 B13R1.537 CN(CF)c1ccc(cc1)C(=O)O 27478041a2682924d0c652648e3d9ed0 [0,2,0,0,0,0|1,0,0]=3 649 B13R1.537 CN(CF)c1ccc(cn1)C(=O)N d4a36f7c0d0a813bcf5b150e8b9be919 [0,2,0,0,0,0|2,0,0]=4 650 B13R1.537 CN(CF)c1ccc(cn1)C(=O)O 0626b6d3b7d0f33f9fd6406b62c1ea3d [0,2,0,0,0,0|2,0,0]=4 651 B13R1.537 CN(CF)c1ccc(nc1)C(=O)O 609a70bd51bf6a39efd3c27248967405 [0,2,0,0,0,0|2,0,0]=4 652 B13R1.537 CN(CO)c1ccc(cc1)C(=O)O 64a4f73086cfd6c6c1cf7acd3820c788 [0,2,0,0,0,0|1,0,0]=3 653 B13R1.537 CN(CO)c1ccc(cc1)[N+](=O)[O-] ea5926ca8d10546a5a88fd16b278c0f1 [0,2,0,0,0,0|2,0,0]=4 654 B13R1.537 CN(CO)c1ccc(cn1)C(=O)N e9ecec43c8ea6593c369dbf82cd19210 [0,2,0,0,0,0|2,0,0]=4 655 B13R1.537 CN(CO)c1ccc(cn1)C(=O)O 605f4596cdebb770455158f5d7459856 [0,2,0,0,0,0|2,0,0]=4 656 B13R1.537 CN(CO)c1ccc(nc1)C(=O)O 56a731156d418b31cc9d713b1ad7cf4e [0,2,0,0,0,0|2,0,0]=4 657 B13R1.3088 C=Cc1ccc(cc1F)N(C)CC 7f8c81067bfd9bb24f5c22257f7a7d5f [0,2,0,0,0,0|2,0,0]=4 658 B13R1.140 CC(C)(C)c1ccc(cc1)NC=O a196904bf5ca265d4ab91a2c79d0d5fb [0,2,0,0,0,0|0,0,0]=2 659 B13R1.140 CC(C)(C)c1ccc(cc1)NCF f8303fc9b3ce4b4011fe67eb09113567 [0,2,0,0,0,0|1,0,1]=4 660 B13R1.140 CC(C)(C)c1ccc(cc1)NCO 65bb8bac36e536c6747f56a825d33438 [0,2,0,0,0,0|0,0,2]=4 661 B13R1.140 CC(C)(C)c1ccc(cc1)OCF fce347432b8f7a62f7571a9c92162acb [0,2,0,0,0,0|1,0,1]=4 662 B13R1.140 CC(C)(C)c1ccc(nc1)NC=O 8edef5aa3e392c8f8bc0e5b1ff010686 [0,2,0,0,0,0|1,0,0]=3 663 B13R1.140 CC(C)(C)c1ccc(nn1)NC=O bbaf3ab3f1e8ab2b8c991a7a9d4b38ec [0,2,0,0,0,0|2,0,0]=4 664 B13R1.140 CC(C)(C)c1ncc(cn1)NC=O 9466edeaa147a21cf72744f4b8c1df9b [0,2,0,0,0,0|2,0,0]=4 665 B13R1.140 CC(C)(O)c1ccc(cn1)NC=O 38d0395cad4b5143594134f93e0fb46f [0,2,0,0,0,0|1,0,0]=3 666 B13R1.140 CC(C)(O)c1ccc(nc1)NC=O 40e12e55eca4eaae8f00b9f39d7c5c8f [0,2,0,0,0,0|1,0,0]=3 667 B13R1.140 CC(C)(O)c1cnc(cn1)NC=O c668bba500279b07ae58d510af796d0c [0,2,0,0,0,0|2,0,0]=4 668 B13R1.140 CCNc1ccc(cc1)C(C)(C)C bb72fcaa4ae3cf80d2347f66c074516e [0,2,0,0,0,0|1,0,1]=4 669 B13R1.140 CCOc1ccc(cc1)C(C)(C)C 218cf34fec20cb444f5f944bee2c7458 [0,2,0,0,0,0|1,0,1]=4 670 B13R1.140 CS(=O)(=O)c1ccc(cc1)NC=O 488d03a071904fca754b252a4c462c9a [0,2,0,0,0,0|2,0,0]=4 671 B13R1.140 O=CNc1ccc(cc1)C(F)(F)F fe202a90871aa31f4fb189166b21b8b3 [0,2,0,0,0,0|2,0,0]=4 672 B13R1.144 CC(=O)c1ccc(c(c1)Br)NC=O 058e0462431a9d750567ab4fafe70cc3 [0,2,0,0,0,0|1,0,1]=4 673 B13R1.144 CC(=O)c1ccc(c(c1)C)NC=O 15819ba50f3656c937ca5f77d00b5436 [0,2,0,0,0,0|1,0,1]=4 674 B13R1.144 CC(=O)c1ccc(c(c1)Cl)NC=O 0bfee33320ae06e0fdf7800ac21dd3f1 [0,2,0,0,0,0|1,0,1]=4 675 B13R1.144 CC(=O)c1ccc(c(c1)F)NC=O 4364940e766b80001652a9f193f115c1 [0,2,0,0,0,0|1,0,1]=4 676 B13R1.144 CC(=O)c1ccc(c(c1)I)NC=O 3947d66582eb7204bef08aab1d321824 [0,2,0,0,0,0|1,0,1]=4 677 B13R1.144 CC(=O)c1ccc(c(c1)O)NC=O ac8d9c4a6a24147306d572b92ee5eaa5 [0,2,0,0,0,0|1,0,1]=4 678 B13R1.144 CC(C)c1ccc(c(c1)Br)NC=O 74d37f998e9340a7b86af2604d1e4134 [0,2,0,0,0,0|0,0,0]=2 679 B13R1.144 CC(C)c1ccc(c(c1)Cl)NC=O 2e822b1492175e846721ea5d8f00a148 [0,2,0,0,0,0|0,0,0]=2 680 B13R1.144 CC(C)c1ccc(c(c1)Cl)NCF 1b7b0c6c766314e4eac71a03afa84f9b [0,2,0,0,0,0|1,0,1]=4 681 B13R1.144 CC(C)c1ccc(c(c1)Cl)NCO 23ae04f05b157d4b149698af208046d4 [0,2,0,0,0,0|0,0,2]=4 682 B13R1.144 CC(C)c1ccc(c(c1)Cl)OCF 1f7ef3b00112dd85c405c0f4c9280e3e [0,2,0,0,0,0|1,0,1]=4 683 B13R1.144 CC(C)c1ccc(c(c1)F)NC=O 960ddeaf45b427cfa7ae8559da99cabd [0,2,0,0,0,0|0,0,0]=2 684 B13R1.144 CC(C)c1ccc(c(c1)I)NC=O ae3197695d41ddff9426f9220c914a3f [0,2,0,0,0,0|0,0,0]=2 685 B13R1.144 CC(C)c1ccc(c(c1)I)NCF 10d1434c7f6d846e53aeaad56ef5f79e [0,2,0,0,0,0|1,0,1]=4 686 B13R1.144 CC(C)c1ccc(c(c1)I)NCO 4d9eb6dab6eb00216132af879754ef6e [0,2,0,0,0,0|0,0,2]=4 687 B13R1.144 CC(C)c1ccc(c(c1)O)NC=O 4a8c771fe793d582f9bfa701f8b60f35 [0,2,0,0,0,0|0,0,0]=2 688 B13R1.144 CC(C)c1cnc(c(c1)Br)NC=O 45d72b54c590746e0a04e6da219a7cde [0,2,0,0,0,0|1,0,0]=3 689 B13R1.144 CCNc1ccc(cc1Cl)C(C)C 9d10d419d3f5ff01f37bb87145541858 [0,2,0,0,0,0|1,0,1]=4 690 B13R1.144 CCNc1ccc(cc1I)C(C)C 4ca5eefdf09d9cc75db1c647eddae823 [0,2,0,0,0,0|1,0,1]=4 691 B13R1.144 CCOc1ccc(cc1C)C(C)C d0ed0d8aefd209e078500109064030be [0,2,0,0,0,0|1,0,1]=4 692 B13R1.144 CCOc1ccc(cc1Cl)C(C)C f6eaf194d22d0d089c85eeea964446f9 [0,2,0,0,0,0|1,0,1]=4 693 B13R1.144 CN(C)c1ccc(c(c1)Br)NC=O 63d907d032e5246893aaf09870f64e10 [0,2,0,0,0,0|1,0,0]=3 694 B13R1.144 CN(C)c1ccc(c(c1)F)NC=O c6527797b538698dbeea79e682023bd4 [0,2,0,0,0,0|1,0,0]=3 695 B13R1.144 Cc1cc(ccc1OCF)C(C)C 08baaf57eebb0c960580ac1ebbb495ef [0,2,0,0,0,0|1,0,1]=4 696 B13R1.74 C#CCNc1ccc(cc1)C(C)C 47e04ab8397a5814250c668a0c886ddc [0,2,0,0,0,0|1,0,1]=4 697 B13R1.74 C#CCOc1ccc(cc1)C(C)C 24e83038a46ffff764c4b40efd24fe7f [0,2,0,0,0,0|1,0,1]=4 698 B13R1.74 C=C(C)c1ccc(cc1)OCC=O 30e2945ff8be6ac394d4f2fadbf09cee [0,2,0,0,0,0|0,0,2]=4 699 B13R1.74 C=CCNc1ccc(cc1)C(C)C bcfd8a722a5d459a83478a868296b71e [0,2,0,0,0,0|1,0,0]=3 700 B13R1.74 C=CCNc1ccc(cc1)C(C)O e1b32236f8a154a229f1d1b3033399ef [0,2,0,0,0,0|2,0,0]=4 701 B13R1.74 C=CCNc1ccc(cc1)N(C)C 33d709b9aca8131a8423e33b3520c6e5 [0,2,0,0,0,0|2,0,0]=4 702 B13R1.74 C=CCNc1ccc(cn1)C(C)C a0883bdafac7d6f30bd91d3d51d6c823 [0,2,0,0,0,0|2,0,0]=4 703 B13R1.74 C=CCNc1ccc(nc1)C(C)C 13c0b69269570c11c8f1a48eeb20c470 [0,2,0,0,0,0|2,0,0]=4 704 B13R1.74 C=CCOc1ccc(cc1)C(C)C 2c60f5d3bc07e82e0e0ead4aced4434d [0,2,0,0,0,0|1,0,0]=3 705 B13R1.74 C=CCOc1ccc(cc1)N(C)C bce20bede04faf4727eeae6ca1b82159 [0,2,0,0,0,0|2,0,0]=4 706 B13R1.74 C=CCOc1ccc(nc1)C(C)C 327fee9b5824bfdad9dd5f90552f52c1 [0,2,0,0,0,0|2,0,0]=4 707 B13R1.74 CC(=O)c1ccc(cc1)CNC=O c7386ec86b2cea4bc722542459300f9a [0,2,0,0,0,0|1,0,1]=4 708 B13R1.74 CC(=O)c1ccc(cc1)NCC=O 9a08798a831a85e08adb375f9450ad17 [0,2,0,0,0,0|1,0,1]=4 709 B13R1.74 CC(=O)c1ccc(cc1)OCC=O 64f6c4a4ae4e15adc4f9791f4a0f8c05 [0,2,0,0,0,0|1,0,1]=4 710 B13R1.74 CC(C)c1ccc(cc1)CNC#N 6bed7e0b2bbb2e4121fee60dbd2ccb5c [0,2,0,0,0,0|1,0,1]=4 711 B13R1.74 CC(C)c1ccc(cc1)CNC=O 987582e02af15459a896c2c4e306495c [0,2,0,0,0,0|0,0,0]=2 712 B13R1.74 CC(C)c1ccc(cc1)CNCF 5f58f8227edd5b2d10d44a6ca8899a62 [0,2,0,0,0,0|1,0,1]=4 713 B13R1.74 CC(C)c1ccc(cc1)CNCO 4f5dbe496523795c988bade0fd78a93c [0,2,0,0,0,0|0,0,2]=4 714 B13R1.74 CC(C)c1ccc(cc1)COCF dc8310b91f94ad0f39c48dc8820fe858 [0,2,0,0,0,0|0,0,2]=4 715 B13R1.74 CC(C)c1ccc(cc1)NCC#N 2382b8a190ff7a80e16c8f0e635e865b [0,2,0,0,0,0|1,0,1]=4 716 B13R1.74 CC(C)c1ccc(cc1)NCC=O cf094a2569ec8198c9db6754aac7c01f [0,2,0,0,0,0|0,0,0]=2 717 B13R1.74 CC(C)c1ccc(cc1)NCCF 3f9935f6d93539e549803045b4f7f4d8 [0,2,0,0,0,0|1,0,1]=4 718 B13R1.74 CC(C)c1ccc(cc1)NCCO aab2a52411e036ca45c727d2c833e542 [0,2,0,0,0,0|0,0,2]=4 719 B13R1.74 CC(C)c1ccc(cc1)NCCS eff4f772e457caedca7166856cfd5815 [0,2,0,0,0,0|0,1,1]=4 720 B13R1.74 CC(C)c1ccc(cc1)OCC#N c88db46a2a0f557e4318c686efd26eb0 [0,2,0,0,0,0|1,0,1]=4 721 B13R1.74 CC(C)c1ccc(cc1)OCC=O 172d1a1860f99d95d72289cf2d49d068 [0,2,0,0,0,0|0,0,0]=2 722 B13R1.74 CC(C)c1ccc(cc1)OCCF 72cb1f735387895734d6fc9a2f36b2a7 [0,2,0,0,0,0|1,0,1]=4 723 B13R1.74 CC(C)c1ccc(cc1)OCCS 1bb2efaef61ab3d76d9f18c04535d735 [0,2,0,0,0,0|0,1,1]=4 724 B13R1.74 CC(C)c1ccc(cn1)NCC=O 8e30fe77aaef81244c5ea3591071be79 [0,2,0,0,0,0|1,0,0]=3 725 B13R1.74 CC(C)c1ccc(cn1)OCC=O 75150a3e79aa849bfb841dc3be4dbfc4 [0,2,0,0,0,0|1,0,0]=3 726 B13R1.74 CC(C)c1ccc(nc1)NCC=O 0852469c31e14de4be6133179aeff161 [0,2,0,0,0,0|1,0,0]=3 727 B13R1.74 CC(C)c1ccc(nn1)NCC=O 5992675084f549677b464f0e735b6675 [0,2,0,0,0,0|2,0,0]=4 728 B13R1.74 CC(C)c1cnc(cn1)NCC=O 6a532a900b9072c68d24f26afae0e62c [0,2,0,0,0,0|2,0,0]=4 729 B13R1.74 CC(C)c1cnc(nc1)NCC=O 6ebee1e552fada87d95802975fcf66e0 [0,2,0,0,0,0|2,0,0]=4 730 B13R1.74 CC(C)c1ncc(cn1)CNC=O 73f155d66f3f61dea7c0d12140e37696 [0,2,0,0,0,0|2,0,0]=4 731 B13R1.74 CC(C)c1ncc(cn1)NCC=O d897c2a117ffd226f71deebb821e5ef5 [0,2,0,0,0,0|2,0,0]=4 732 B13R1.74 CC(O)c1ccc(cc1)CNC=O 2bf502724a3edf5c49bca0a499971b1f [0,2,0,0,0,0|1,0,0]=3 733 B13R1.74 CC(O)c1ccc(cc1)NCC=O 14dffcd03f811d251f96d8f537abccc8 [0,2,0,0,0,0|1,0,0]=3 734 B13R1.74 CCCNc1ccc(cc1)C(C)C deff397f206f70d04a690ec4f87eb40e [0,2,0,0,0,0|1,0,1]=4 735 B13R1.74 CCCOc1ccc(cc1)C(C)C f728ec32cf4795dcc158b2fe7644b8a9 [0,2,0,0,0,0|1,0,1]=4 736 B13R1.74 CCNCc1ccc(cc1)C(C)C fe5d90905543c2b950304dbc4f0bbc09 [0,2,0,0,0,0|1,0,1]=4 737 B13R1.74 CCOCc1ccc(cc1)C(C)C 747ef3d1399927eed4934abfa9f177f1 [0,2,0,0,0,0|0,0,2]=4 738 B13R1.74 CN(C)c1ccc(cc1)CNC=O a69c34eb52a30a87226cc95f98bd5731 [0,2,0,0,0,0|1,0,0]=3 739 B13R1.74 CN(C)c1ccc(cc1)NCC=O e0f419ad1941d083fe6049f352f83db4 [0,2,0,0,0,0|1,0,0]=3 740 B13R1.74 CN(C)c1ccc(cc1)OCC=O 6932baff564fc8c0fc6e48c0d8bf10f4 [0,2,0,0,0,0|1,0,0]=3 741 B13R1.74 CN(C)c1ccc(cn1)CNC=O af01a9451ef486c0e9521001571ddb5c [0,2,0,0,0,0|2,0,0]=4 742 B13R1.74 CN(C)c1ccc(cn1)NCC=O 8dc230c0563a8676c609e1a27ee8c962 [0,2,0,0,0,0|2,0,0]=4 743 B13R1.74 CN(C)c1ccc(cn1)OCC=O e5df8241fb71b9e8f13f72beea041f07 [0,2,0,0,0,0|2,0,0]=4 744 B13R1.74 CN(C)c1ccc(nc1)NCC=O 98cf6e5f24496d38ca5abf177d6d6ba7 [0,2,0,0,0,0|2,0,0]=4 745 B13R1.74 COCNc1ccc(cc1)C(C)C 90c2b44b2bf6be868a4d8f9f0b0ee194 [0,2,0,0,0,0|0,0,2]=4 746 B13R1.74 COCOc1ccc(cc1)C(C)C 172cc245da6e91fcf95eff4034178b2a [0,2,0,0,0,0|0,0,2]=4 747 B13R1.74 CS(=O)c1ccc(cc1)NCC=O fe2288e1b9fad937b5e3584b568e323a [0,2,0,0,0,0|2,0,0]=4 748 B13R1.74 CS(=O)c1ccc(cc1)OCC=O 98bf10ebab20689235fcd0c68364607a [0,2,0,0,0,0|2,0,0]=4 749 B13R1.74 CSCNc1ccc(cc1)C(C)C 9b0889b0c68b92ea1958901495575d58 [0,2,0,0,0,0|0,1,1]=4 750 B13R1.74 CSCOc1ccc(cc1)C(C)C 9541b5b324300c980e02e0dcd9aa16b9 [0,2,0,0,0,0|0,1,1]=4 751 B13R1.74 O=CNCc1ccc(cc1)C(F)F 0ad427e73baa643a0a6b4ae7b4dd7b75 [0,2,0,0,0,0|2,0,0]=4 752 B13R1.385 CC(=O)c1ccc(cc1Br)NC=O 4726fe3460b2157004096b029652376d [0,2,0,0,0,0|1,0,1]=4 753 B13R1.385 CC(=O)c1ccc(cc1Cl)NC=O 6fd0721229dce2850dbfa8cac8c30ddf [0,2,0,0,0,0|1,0,1]=4 754 B13R1.385 CC(=O)c1ccc(cc1F)NC=O 951dd874a52b44a2dfc35231f7fcb9c0 [0,2,0,0,0,0|1,0,1]=4 755 B13R1.385 CC(=O)c1ccc(cc1O)NC=O 3ba462f2223883f50fa72a396dbb74ab [0,2,0,0,0,0|1,0,1]=4 756 B13R1.385 CC(C)c1ccc(cc1Br)NC=O dd5b26fac7dd471d72ecf4b2674a30f7 [0,2,0,0,0,0|0,0,0]=2 757 B13R1.385 CC(C)c1ccc(cc1F)NC=O 3f37c63d2c672cd2fb4ce9c809d84921 [0,2,0,0,0,0|0,0,0]=2 758 B13R1.385 CC(C)c1ccc(cc1F)NCF 15d0ad7166d38df253c174e0b570c7c9 [0,2,0,0,0,0|1,0,1]=4 759 B13R1.385 CC(C)c1ccc(cc1F)NCO bbdbf380ddece6ece58cbfa4b604e188 [0,2,0,0,0,0|0,0,2]=4 760 B13R1.385 CC(C)c1ccc(cc1O)NC=O 9b11c8054f9a8d279df3615951b9e088 [0,2,0,0,0,0|0,0,0]=2 761 B13R1.385 CC(C)n1ccc(cc1=O)NC=O eec72bee5107772bbfa3e82be900e993 [0,2,0,0,0,0|1,0,0]=3 762 B13R1.385 CCNc1ccc(c(c1)F)C(C)C 34e961703cbbe04fc1fa85443c979da3 [0,2,0,0,0,0|1,0,1]=4 763 B13R1.385 CCOc1ccc(c(c1)C)C(C)C a32edf9d320edf0cb5c922f1eb20cba5 [0,2,0,0,0,0|1,0,1]=4 764 B13R1.385 CN(C)c1ccc(cc1Br)NC=O 3c0c5642ea7bbb242103db6acc3b1890 [0,2,0,0,0,0|1,0,0]=3 765 B13R1.385 CN(C)c1ccc(cc1Cl)NC=O b5f5bc334e71afbd23669b7d7afa390e [0,2,0,0,0,0|1,0,0]=3 766 B13R1.385 CN(C)c1ccc(cc1F)NC=O b1d4e19e4b51bfdc091ed2cf149e19f0 [0,2,0,0,0,0|1,0,0]=3 767 B13R1.385 Cc1cc(ccc1C(C)C)OCF 6e4ede8b37ac9ad4bb958b15ebdc1df6 [0,2,0,0,0,0|1,0,1]=4 768 B13R1.385 Cc1cc(ccc1N(C)C)NC=O 67f038ddc7e51a8caa847b342fc9bccb [0,2,0,0,0,0|1,0,0]=3 769 B13R1.385 O=CNc1ccc(c(c1)Br)C(F)F 6ad2ae4310adc8abbc9543846aed642a [0,2,0,0,0,0|2,0,0]=4 770 B13R1.385 O=CNc1ccc(c(c1)F)C(F)F 4e3a11a67ee4b1e1b5521583decfacd6 [0,2,0,0,0,0|2,0,0]=4 771 B11R1.43 CC(C)Oc1csc(c1)C=O 12b452ebc1206aac256c8c9ca9aeb624 [0,0,1,1,0,0|2,0,0]=4 772 B13R2.184 C=Cc1ccc(cc1)NC2CC2 f0ed6410b14ec2f5108d7802d3e5b0a0 [0,0,0,1,0,1|1,0,0]=3 773 B13R2.184 C=Cc1ccc(cc1)OC2CC2 fc7742cea7e0d2e17389fa4147491599 [0,0,0,1,0,1|1,0,0]=3 774 B13R2.184 C=Cc1ccc(cn1)NC2CC2 02f3c5bb7fb814fed66ed5fa8ac1fdde [0,0,0,1,0,1|2,0,0]=4 775 B13R2.184 C=Cc1ccc(nc1)NC2CC2 0519d9ee753b953149841b038dce8b90 [0,0,0,1,0,1|2,0,0]=4 776 B13R2.184 COc1ccc(cc1)NC2CC2 8a60685a02cd74a57f4131823848e1a7 [0,0,0,1,0,1|2,0,0]=4 777 B13R2.184 COc1ccc(cc1)OC2CC2 32ae0b830a81575e6ad6b82b001de835 [0,0,0,1,0,1|2,0,0]=4 778 B13R2.184 O=Cc1ccc(cc1)NC2CC2 f2e0060be359d1303c2c58d21098c3c4 [0,0,0,1,0,1|0,0,0]=2 779 B13R2.184 O=Cc1ccc(cc1)OC2CC2 ed923a70e89e60f0ec478f0c884fcc07 [0,0,0,1,0,1|0,0,0]=2 780 B13R2.184 O=Cc1ccc(cn1)NC2CC2 d626e582b4de532112f9d843c6ebe86b [0,0,0,1,0,1|1,0,0]=3 781 B13R2.184 O=Cc1ccc(cn1)OC2CC2 819f0fc51a86d437c8a1b94d27861475 [0,0,0,1,0,1|1,0,0]=3 782 B13R2.184 O=Cc1ccc(nc1)NC2CC2 f539ec8755c4ec36bdf9c418f638ee59 [0,0,0,1,0,1|1,0,0]=3 783 B13R2.184 O=Cc1ccc(nc1)OC2CC2 bd57a57edb60be8ab222edb9d716ca94 [0,0,0,1,0,1|1,0,0]=3 784 B13R2.184 O=Cc1ccc(nn1)NC2CC2 f23c8b2aca67dfb562a811b3a7a265d6 [0,0,0,1,0,1|2,0,0]=4 785 B13R2.184 O=Cc1ccc(nn1)OC2CC2 cc351fd42db3e785dc13ecf4027aac41 [0,0,0,1,0,1|2,0,0]=4 786 B13R2.184 O=Cc1cnc(cn1)NC2CC2 885e55a6470cd3f0b3c516475fc3e49e [0,0,0,1,0,1|2,0,0]=4 787 B13R2.184 O=Cc1cnc(nc1)NC2CC2 b0988cda0ba82433dcb20b2916e04354 [0,0,0,1,0,1|2,0,0]=4 788 B13R2.184 O=Cc1cnc(nc1)OC2CC2 457f10a2494f254a46d28c94fa20803d [0,0,0,1,0,1|2,0,0]=4 789 B13R2.184 O=Cc1ncc(cn1)NC2CC2 4674a095994ed010e519979783065151 [0,0,0,1,0,1|2,0,0]=4 790 B13R2.1279 CC(C)Nc1ccc2c(c1)CC2 753a6311546bf17206a5abf400f5bee0 [0,0,0,1,0,1|1,0,1]=4 791 B13R2.60 CCNc1ccc(cc1)C2CC2 e9bf454f2bdc74a028c10d3ba810057e [0,1,0,1,0,0|1,0,1]=4 792 B13R2.60 CCOc1ccc(cc1)C2CC2 0d73b61ea3ec429f7b035cbd1c203358 [0,1,0,1,0,0|1,0,1]=4 793 B13R2.60 FCNc1ccc(cc1)C2CC2 9325aa1b2446f524a7f752ba73689d68 [0,1,0,1,0,0|1,0,1]=4 794 B13R2.60 FCOc1ccc(cc1)C2CC2 1acf634f051d08f7c9a5fb845916d921 [0,1,0,1,0,0|1,0,1]=4 795 B13R2.60 O=CNc1ccc(cc1)C2CC2 7e82816d12dc8aaad4e943b69c8fe90e [0,1,0,1,0,0|0,0,0]=2 796 B13R2.60 O=CNc1ccc(cn1)C2CC2 6a80a3cc3c406d05abf0d441d6e383b6 [0,1,0,1,0,0|1,0,0]=3 797 B13R2.60 O=CNc1ccc(nc1)C2CC2 81f0918a31709597c5a3ca978b6446a2 [0,1,0,1,0,0|1,0,0]=3 798 B13R2.60 OCNc1ccc(cc1)C2CC2 c3e2ff2164a3d78ef3cea7936172ccaa [0,1,0,1,0,0|0,0,2]=4 799 B11R1.20 CC(C)Nc1ccc(=O)[nH]c1 63657213ff6b579908dedea051a64186 [1,0,0,0,0,1|1,0,0]=3 800 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [1,0,0,0,0,1|1,0,0]=3 801 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [1,0,0,0,0,1|1,0,0]=3 802 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [1,0,0,0,0,1|1,0,0]=3 803 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [1,0,0,0,0,1|1,0,0]=3 804 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [1,0,0,0,0,1|0,1,0]=3 805 B11R1.20 CC(C)Nc1ccc(cn1)Br 9b1d22e0d0da20412cc097462da94620 [1,0,0,0,0,1|2,0,0]=4 806 B11R1.20 CC(C)Nc1ccc(cn1)Cl 5ae73597a5a1fa64ce292b318939abee [1,0,0,0,0,1|2,0,0]=4 807 B11R1.20 CC(C)Nc1ccc(cn1)F 6d484441b7055ef582d9e9fe1a736c28 [1,0,0,0,0,1|2,0,0]=4 808 B11R1.20 CC(C)Nc1ccc(cn1)I d7825663ab6a7ded0de82b19c2a89f36 [1,0,0,0,0,1|2,0,0]=4 809 B11R1.20 CC(C)Nc1ccc(nc1)Br a219ac4b34332eb3738a2d60093d25ca [1,0,0,0,0,1|2,0,0]=4 810 B11R1.20 CC(C)Nc1ccc(nc1)Cl cd874efcc56ef7f4e81f67a347da5256 [1,0,0,0,0,1|2,0,0]=4 811 B11R1.20 CC(C)Nc1ccc(nc1)F e5037e278c2deb1da56d4dd59d5edb3e [1,0,0,0,0,1|2,0,0]=4 812 B11R1.20 CC(C)Nc1cnc(=O)[nH]c1 5b45c35c1194a8fd5e035367d4d905a3 [1,0,0,0,0,1|2,0,0]=4 813 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [1,0,0,0,0,1|1,0,0]=3 814 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [1,0,0,0,0,1|1,0,0]=3 815 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [1,0,0,0,0,1|1,0,0]=3 816 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [1,0,0,0,0,1|1,0,0]=3 817 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [1,0,0,0,0,1|0,1,0]=3 818 B11R1.20 CC(C)Oc1ccc(cn1)Cl 2d764f542cd850467dceb5ea7856809e [1,0,0,0,0,1|2,0,0]=4 819 B11R1.20 CC(C)Oc1ccc(cn1)F 8b718d6ec6cce88e81ab345ae3477032 [1,0,0,0,0,1|2,0,0]=4 820 B11R1.20 CC(C)Oc1ccc(cn1)I 00aba9b6fb1d651d79b062e296bef87f [1,0,0,0,0,1|2,0,0]=4 821 B11R1.20 CC(C)Oc1ccc(nc1)Br 03387980ed704f1b91f33115fdf148c9 [1,0,0,0,0,1|2,0,0]=4 822 B11R1.20 CC(C)Oc1ccc(nc1)Cl bf70b6eb15a088db8ddeb63733ed08d7 [1,0,0,0,0,1|2,0,0]=4 823 B11R1.20 CC(C)Oc1ccc(nc1)F c1100a1e2d454cfe8c3cbbc5d6e5727d [1,0,0,0,0,1|2,0,0]=4 824 B11R1.20 CC(C)Oc1ccc(nc1)I 86c15c6da9d65de15ebd86f541f4105e [1,0,0,0,0,1|2,0,0]=4 825 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [1,0,0,0,0,1|0,0,1]=3 826 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [1,0,0,0,0,1|0,0,1]=3 827 B11R1.20 Cc1ccc(cn1)NC(C)C 743454483328eed9afd36a5108a5fde3 [1,0,0,0,0,1|1,0,1]=4 828 B11R1.20 Cc1ccc(cn1)OC(C)C 587bf2eefeb78be461683015f0e1ab8b [1,0,0,0,0,1|1,0,1]=4 829 B11R1.20 Cc1ccc(nc1)NC(C)C 2fd0646075e4e7895badb9a91550ac5c [1,0,0,0,0,1|1,0,1]=4 830 B11R1.20 Cc1ccc(nc1)OC(C)C daaa0dc9632c23fcd00a8fbb104724aa [1,0,0,0,0,1|1,0,1]=4 831 B13R1.3 C#Cc1ccc(cc1)CNC(C)C e6f0eddd3a5b5bbdc992e93e090dc57e [0,0,0,0,0,2|1,0,1]=4 832 B13R1.3 C#Cc1ccc(cc1)COC(C)C 0f6668dafcb66fc1759022ebe4e861e7 [0,0,0,0,0,2|1,0,1]=4 833 B13R1.3 C#Cc1ccc(cc1)NCC(C)C b448a80cca2cbe185fed7e54e440bca7 [0,0,0,0,0,2|1,0,1]=4 834 B13R1.3 C#Cc1ccc(cc1)OCC(C)C f85caf3e33cf6ef4f5f3f4a05623238d [0,0,0,0,0,2|1,0,1]=4 835 B13R1.3 C=C(C)CNc1ccc(cc1)C=O a22b7de44af4fa5bcf54e2061dd37a1e [0,0,0,0,0,2|0,0,2]=4 836 B13R1.3 C=C(C)COc1ccc(cc1)C=O a8f77e8e55f752fa87059865bb9e4fde [0,0,0,0,0,2|0,0,2]=4 837 B13R1.3 C=Cc1ccc(cc1)CNC(C)C 36156cd70321a67f6dce4d9b7bffeb2a [0,0,0,0,0,2|1,0,0]=3 838 B13R1.3 C=Cc1ccc(cc1)COC(C)C 85e2bb35b140ef4f8f0a4b73296ad60d [0,0,0,0,0,2|1,0,0]=3 839 B13R1.3 C=Cc1ccc(cc1)NCC(C)C 781e5a171ff9a20d32354270e0f893e0 [0,0,0,0,0,2|1,0,0]=3 840 B13R1.3 C=Cc1ccc(cc1)NCC(C)O 48475e864f8b806c58394d44235ec5f9 [0,0,0,0,0,2|2,0,0]=4 841 B13R1.3 C=Cc1ccc(cc1)NCN(C)C 174b00aa0513b8686739e634c8ab229c [0,0,0,0,0,2|2,0,0]=4 842 B13R1.3 C=Cc1ccc(cc1)NC[C@@H](C)O a4196b6fc4dcb707318418df43eab182 [0,0,0,0,0,2|2,0,0]=4 843 B13R1.3 C=Cc1ccc(cc1)NC[C@H](C)O 2d2ae657ba5268e92234ee416a668161 [0,0,0,0,0,2|2,0,0]=4 844 B13R1.3 C=Cc1ccc(cc1)OCC(C)C 34986f0447a1d8df589cdb05ca8dd96f [0,0,0,0,0,2|1,0,0]=3 845 B13R1.3 C=Cc1ccc(cc1)OCN(C)C 69e17057fc35b1a4666d7a7e9eb4ed20 [0,0,0,0,0,2|2,0,0]=4 846 B13R1.3 C=Cc1ccc(cn1)NCC(C)C e35fd8f9f49c009f53f4cb642e5c4b3e [0,0,0,0,0,2|2,0,0]=4 847 B13R1.3 C=Cc1ccc(nc1)NCC(C)C 35c18cb787dccd95b7c3ff61514b35c5 [0,0,0,0,0,2|2,0,0]=4 848 B13R1.3 CC(=O)CNc1ccc(cc1)C=O 7fdbfbdf5c7ce499127ea1f1399a425a [0,0,0,0,0,2|1,0,1]=4 849 B13R1.3 CC(C)CNc1ccc(cc1)C#N 73a3a01fb501dfd0ab27eed96db17441 [0,0,0,0,0,2|1,0,1]=4 850 B13R1.3 CC(C)CNc1ccc(cc1)C=O 53d7bacb8b11cdad75957b6e67532b07 [0,0,0,0,0,2|0,0,0]=2 851 B13R1.3 CC(C)CNc1ccc(cc1)CO 475a078da820895fbef270579cdd2330 [0,0,0,0,0,2|0,0,2]=4 852 B13R1.3 CC(C)CNc1ccc(cn1)C=O 9feb6227bf72eccf43e8d233da0e7556 [0,0,0,0,0,2|1,0,0]=3 853 B13R1.3 CC(C)CNc1ccc(nc1)C=O 2e7a997b6dbbc8ec24a3fa42e7b64baf [0,0,0,0,0,2|1,0,0]=3 854 B13R1.3 CC(C)CNc1ccc(nn1)C=O 12c236aef85d72d0fc134390ed9ea806 [0,0,0,0,0,2|2,0,0]=4 855 B13R1.3 CC(C)CNc1cnc(cn1)C=O e9511e7fdc89dbdaaeaf26908083264e [0,0,0,0,0,2|2,0,0]=4 856 B13R1.3 CC(C)CNc1cnc(nc1)C=O ad23a870edeb9faaecda9301282d5567 [0,0,0,0,0,2|2,0,0]=4 857 B13R1.3 CC(C)CNc1ncc(cn1)C=O b4f6c8cbfb932d1d5fb5b938d7bc2598 [0,0,0,0,0,2|2,0,0]=4 858 B13R1.3 CC(C)COc1ccc(cc1)C#N 4fe0bacc21bc3eb30ffa7dd21031ffa4 [0,0,0,0,0,2|1,0,1]=4 859 B13R1.3 CC(C)COc1ccc(cc1)C=O 8198abae2efc6ea28144bbd6f6f4c2b6 [0,0,0,0,0,2|0,0,0]=2 860 B13R1.3 CC(C)COc1ccc(cc1)N=O d4a06c8ac17441d5e97c0940348f1721 [0,0,0,0,0,2|1,0,0]=3 861 B13R1.3 CC(C)COc1ccc(cn1)C=O 7daed07df10a03faf2c643da1ec0fe02 [0,0,0,0,0,2|1,0,0]=3 862 B13R1.3 CC(C)COc1ccc(nc1)C=O 91745a261bbcba61045c5c0c84882fb8 [0,0,0,0,0,2|1,0,0]=3 863 B13R1.3 CC(C)COc1ccc(nn1)C=O 86e62f1b0ba2f87a15828a09a3a1355f [0,0,0,0,0,2|2,0,0]=4 864 B13R1.3 CC(C)COc1ncc(cn1)C=O a611f7ae7a1bf856a31f615554b1157d [0,0,0,0,0,2|2,0,0]=4 865 B13R1.3 CC(C)NCc1ccc(cc1)C#N 5f1a2888ef246a0dd3ce103330e0a45e [0,0,0,0,0,2|1,0,1]=4 866 B13R1.3 CC(C)NCc1ccc(cc1)CBr 398b1249d90b420f415abf4423ebfcd6 [0,0,0,0,0,2|1,0,1]=4 867 B13R1.3 CC(C)NCc1ccc(cc1)CO 83fc7d492e8eb1f878b070cdf3d4efc9 [0,0,0,0,0,2|0,0,2]=4 868 B13R1.3 CC(C)OCc1ccc(cc1)C#N 8e5521a00da548fbeeadb0403744d151 [0,0,0,0,0,2|1,0,1]=4 869 B13R1.3 CC(C)OCc1ccc(cc1)C=O 3dc828b0457d8cfec1ad59575e96f3a7 [0,0,0,0,0,2|0,0,0]=2 870 B13R1.3 CC(C)OCc1ccc(nc1)C=O 5fef3d586cff95adced2df1066476b60 [0,0,0,0,0,2|1,0,0]=3 871 B13R1.3 CC(C)OCc1cnc(nc1)C=O 30fdac26118718a5b47e28e40bda552e [0,0,0,0,0,2|2,0,0]=4 872 B13R1.3 CC(C)OCc1ncc(cn1)C=O e76284c20ee8793f6d1b4869eb5cb872 [0,0,0,0,0,2|2,0,0]=4 873 B13R1.3 CC(O)CNc1ccc(cc1)C=O 69f54016a0f9320b809f4e403c041bb2 [0,0,0,0,0,2|1,0,0]=3 874 B13R1.3 CC(O)CNc1ccc(cn1)C=O 5b8a6d9c3dab669b626c9c5199aff537 [0,0,0,0,0,2|2,0,0]=4 875 B13R1.3 CC(O)CNc1ccc(nc1)C=O 452deb1e8700c5ad1ad40b5aa7bdbbb8 [0,0,0,0,0,2|2,0,0]=4 876 B13R1.3 CCc1ccc(cc1)CNC(C)C b9c2f38bc6cd20d970d94f64e93c67b1 [0,0,0,0,0,2|1,0,1]=4 877 B13R1.3 CCc1ccc(cc1)COC(C)C 827f94870fd24c10258aa66fde5c5351 [0,0,0,0,0,2|1,0,1]=4 878 B13R1.3 CCc1ccc(cc1)NCC(C)C e30c6bf49e3ffe79224312d78baf9dbe [0,0,0,0,0,2|1,0,1]=4 879 B13R1.3 CCc1ccc(cc1)OCC(C)C f97007c9dd123abfb4a58b8449aebe77 [0,0,0,0,0,2|1,0,1]=4 880 B13R1.3 CN(C)CNc1ccc(cc1)C=O 961958870d050cbfb59df2ea73a97c72 [0,0,0,0,0,2|1,0,0]=3 881 B13R1.3 CN(C)CNc1ccc(cn1)C=O 9d7f577672734bee421fd35e1c5ee3a4 [0,0,0,0,0,2|2,0,0]=4 882 B13R1.3 CN(C)CNc1ccc(nc1)C=O 5b395056ba11de9a56363c7a5d2309e3 [0,0,0,0,0,2|2,0,0]=4 883 B13R1.3 CN(C)COc1ccc(cc1)C=O 5b9388795f8bcd7e0d29bb49eccd3b4c [0,0,0,0,0,2|1,0,0]=3 884 B13R1.3 CN(C)COc1ccc(cc1)N=O 1cdaabcdd7d86d3a759d513e1bc78743 [0,0,0,0,0,2|2,0,0]=4 885 B13R1.3 CN(C)COc1ccc(cn1)C=O 86914f223495776ae8d78d0ab982904b [0,0,0,0,0,2|2,0,0]=4 886 B13R1.3 CN(C)COc1ccc(nc1)C=O 3e468355a6eaf324459abdcf7373864a [0,0,0,0,0,2|2,0,0]=4 887 B13R1.3 COc1ccc(cc1)CNC(C)C 3fbab2f6fdf968d7c6962002435840ea [0,0,0,0,0,2|2,0,0]=4 888 B13R1.3 COc1ccc(cc1)COC(C)C 544cb0beac466d1fe5b9a011f927534f [0,0,0,0,0,2|2,0,0]=4 889 B13R1.3 COc1ccc(cc1)NCC(C)C 59d476837cb9437d0f607ea9cdf30362 [0,0,0,0,0,2|2,0,0]=4 890 B13R1.3 COc1ccc(cc1)OCC(C)C 702223f0df1fa37a2ba27c84ba97d5c6 [0,0,0,0,0,2|2,0,0]=4 891 B13R1.3 CSc1ccc(cc1)CNC(C)C 06d944333356b173a767d044193301c1 [0,0,0,0,0,2|2,0,0]=4 892 B13R1.3 CSc1ccc(cc1)COC(C)C 3edb920351d9bedc07b37dfcc2842c1e [0,0,0,0,0,2|2,0,0]=4 893 B13R1.3 CSc1ccc(cc1)NCC(C)C f4acb69e5e3c22ed6095ed3eea326cfc [0,0,0,0,0,2|2,0,0]=4 894 B13R1.3 CSc1ccc(cc1)OCC(C)C 214d475302763d1a9483c75a9a786470 [0,0,0,0,0,2|2,0,0]=4 895 B13R1.3 C[C@@H](O)CNc1ccc(cc1)C=O f7c74193d876da0824b587bf4dfa26ea [0,0,0,0,0,2|1,0,0]=3 896 B13R1.3 C[C@@H](O)CNc1ccc(cn1)C=O fb5517809a6d680143c0fa0b12782eff [0,0,0,0,0,2|2,0,0]=4 897 B13R1.3 C[C@@H](O)CNc1ccc(nc1)C=O 8ad76e9891be8083981277d7e0c63c7d [0,0,0,0,0,2|2,0,0]=4 898 B13R1.3 C[C@H](O)CNc1ccc(cc1)C=O f75111789d576b9b2a297e94bf155039 [0,0,0,0,0,2|1,0,0]=3 899 B13R1.3 C[C@H](O)CNc1ccc(cn1)C=O b61d90670d4a73b54ae0b400f1a2c1cd [0,0,0,0,0,2|2,0,0]=4 900 B13R1.3 C[C@H](O)CNc1ccc(nc1)C=O 57bcf8e895a27d0efbd565cf901abc75 [0,0,0,0,0,2|2,0,0]=4 901 B13R1.3 O=Cc1ccc(cc1)NCC(F)F 83f732496348a05575f6e0470d6e4b1b [0,0,0,0,0,2|2,0,0]=4 902 B13R1.3 O=Cc1ccc(cc1)OCC(F)F 87e1af9305701fe81beef43869c4353b [0,0,0,0,0,2|2,0,0]=4