0 B20R3.5063761 CC(=O)N1c2ccccc2C=Cc3c1cccc3 969425cc712818e17c8c98b857766dea [0,0,0,0,0,0|1,0,0]=1 1 B20R3.5063761 CC(=O)N1c2ccccc2CCc3c1cccc3 541bf13a4dd190ebefc375629403146e [0,0,0,0,0,0|1,0,2]=3 2 B20R3.5063761 CC(=O)N1c2ccccc2COc3c1cccc3 4f9b8f6b9937d296b29ed2c885f4e9bc [0,0,0,0,0,0|2,0,1]=3 3 B19R3.1757189 CCN1c2ccccc2C=Cc3c1cccc3 96166c5687ea0616d3f1d053bdde006b [1,0,0,0,0,0|1,0,1]=3 4 B19R3.1757189 O=CN1c2ccccc2C=Cc3c1cccc3 fb5ced7628f5fc47dee5abdede6aa7c6 [1,0,0,0,0,0|0,0,0]=1 5 B19R3.1757189 O=CN1c2ccccc2CCc3c1cccc3 59052635ce87cfea4fe2b5f482a2a3fa [1,0,0,0,0,0|0,0,2]=3 6 B19R3.1757189 O=CN1c2ccccc2COc3c1cccc3 af44899d4f6426ef9ee20fcb3ef39647 [1,0,0,0,0,0|1,0,1]=3 7 B21R3.3846869 CC(=O)N1c2ccccc2CCc3c1cc(cc3)Cl 5d626c57a47dbfeb4eac04a75edaa0ee [0,1,0,0,0,0|1,0,2]=4 8 B21R3.6855163 CC(=O)N1c2ccccc2C(=O)Nc3c1nccc3 d9e27b96d737e28cbed910f29ff7563a [0,1,0,0,0,0|3,0,0]=4 9 B21R3.6855163 CC(=O)N1c2ccccc2CC(=O)c3c1cccc3 f7e6844e18abe951e50459897db03e05 [0,1,0,0,0,0|1,0,1]=3 10 B21R3.6855163 CC(=O)N1c2ccccc2CC(c3c1cccc3)O b721b614f9bd1fcf88506bb957ea9a84 [0,1,0,0,0,0|1,0,2]=4 11 B21R3.6855163 CC(=O)N1c2ccccc2NC(=O)c3c1cccc3 19ed68b3fbbdf299c3a1237625e11150 [0,1,0,0,0,0|2,0,0]=3 12 B21R3.6855163 CC(=O)N1c2ccccc2NC(=O)c3c1nccc3 761490fc812e1dde5ddd3a4169725021 [0,1,0,0,0,0|3,0,0]=4 13 B21R3.9509984 C#CC(=O)N1c2ccccc2C=Cc3c1cccc3 d6f4270b3c121e2220e262ffe10bcc1e [0,1,0,0,0,0|1,0,0]=2 14 B21R3.9509984 C#CC(=O)N1c2ccccc2CCc3c1cccc3 b9c255f3253140558d962f9d285e98b3 [0,1,0,0,0,0|1,0,2]=4 15 B21R3.9509984 C#CC(=O)N1c2ccccc2COc3c1cccc3 5b24d7c3bfb1dd0205429677eba07ddf [0,1,0,0,0,0|2,0,1]=4 16 B21R3.9509984 C=CC(=O)N1c2ccccc2C=Cc3c1cccc3 e8888244b6b765e37525925ac7563d3c [0,1,0,0,0,0|1,0,0]=2 17 B21R3.9509984 C=CC(=O)N1c2ccccc2CCc3c1cccc3 7bc4b139805fd1dc98428dc6c7bc0a2e [0,1,0,0,0,0|1,0,2]=4 18 B21R3.9509984 C=CC(=O)N1c2ccccc2COc3c1cccc3 7d5c8e838f7d0beb47166076d2330497 [0,1,0,0,0,0|2,0,1]=4 19 B21R3.9509984 C=CC(C)N1c2ccccc2C=Cc3c1cccc3 17315ffc8ed85cbe128bcd3d58fc8850 [0,1,0,0,0,0|2,0,1]=4 20 B21R3.9509984 CC(C=O)N1c2ccccc2C=Cc3c1cccc3 727f7676a3b597fb1d75e401c9909cf8 [0,1,0,0,0,0|1,0,1]=3 21 B21R3.9509984 CCC(=O)N1c2ccccc2C=Cc3c1cccc3 bae4db7cb41aeeaaedcd73e57054d578 [0,1,0,0,0,0|1,0,0]=2 22 B21R3.9509984 CCC(=O)N1c2ccccc2CCc3c1cccc3 963775aa0755b833eb45ef40230a0d75 [0,1,0,0,0,0|1,0,2]=4 23 B21R3.9509984 CCC(=O)N1c2ccccc2COc3c1cccc3 484d83d06a05f0ec4bc8c3b255eb767b [0,1,0,0,0,0|2,0,1]=4 24 B21R3.9509984 C[C@H](C=O)N1c2ccccc2C=Cc3c1cccc3 013082ff1c9766e2da9d556c78b6a70a [0,1,0,0,0,0|1,0,1]=3 25 B21R3.9509984 O=C(CF)N1c2ccccc2C=Cc3c1cccc3 68b5341ba70aea7123e528342098597f [0,1,0,0,0,0|1,0,0]=2 26 B21R3.9509984 O=C(CF)N1c2ccccc2CCc3c1cccc3 41172c39e1be3cdf62af5921481de329 [0,1,0,0,0,0|1,0,2]=4 27 B21R3.9509984 O=C(CF)N1c2ccccc2COc3c1cccc3 311246029ac9a188a211b710f68f5d2d [0,1,0,0,0,0|2,0,1]=4 28 B21R3.9509984 O=C(CO)N1c2ccccc2C=Cc3c1cccc3 a6015651b0af41554936677f6282150c [0,1,0,0,0,0|1,0,0]=2 29 B21R3.9509984 O=C(CS)N1c2ccccc2C=Cc3c1cccc3 82201d16a435b9dc92735475958bfcbc [0,1,0,0,0,0|1,0,0]=2 30 B21R3.9509984 O=CC(=O)N1c2ccccc2C=Cc3c1cccc3 59add0538f310dc94f6efe119d8f4a53 [0,1,0,0,0,0|1,0,0]=2 31 B21R3.9509984 O=CC(=O)N1c2ccccc2CCc3c1cccc3 2f9ce2c2416e2358b1b2038a3cce485c [0,1,0,0,0,0|1,0,2]=4 32 B21R3.9509984 O=CC(=O)N1c2ccccc2COc3c1cccc3 2a634c1cdd21248f5462f9e3850d4be6 [0,1,0,0,0,0|2,0,1]=4 33 B19R2.7167 CC(=O)N(c1ccccc1C)c2ccccc2C 1b468183a9aa95cd18a1d4f9fbd88b24 [0,0,1,0,0,0|1,0,2]=4 34 B19R2.13525 CC(=O)Nc1ccccc1/C=C/c2ccncc2 957b325ddad730605b6b9820e5870d75 [0,0,1,0,0,0|2,0,0]=3 35 B19R2.13525 CC(=O)Nc1ccccc1NCc2ccccc2 5819315016a3deda996767bb69eda0f2 [0,0,1,0,0,0|2,0,1]=4 36 B19R2.13525 CC(=O)Nc1ccccc1OCc2ccccc2 7882ada98aa06c7b6d291e9255fb3a1a [0,0,1,0,0,0|2,0,1]=4 37 B19R2.13525 CC(=O)Nc1ccccc1SCc2ccccc2 30ca7148f83fabeccf6a869f67a59c2f [0,0,1,0,0,0|2,0,1]=4 38 B19R2.13525 NC(=O)Cc1ccccc1NCc2ccccc2 0ffa0e81b138e8448bcdcafcca93063a [0,0,1,0,0,0|2,0,1]=4 39 B19R2.13525 NC(=O)Cc1ccccc1OCc2ccccc2 3b51007020c2f1b3603922a0818dcfbf [0,0,1,0,0,0|2,0,1]=4 40 B19R2.13525 NC(=O)Nc1ccccc1NCc2ccccc2 6f7a3e918695eb20215683ecb8da3ce5 [0,0,1,0,0,0|1,0,1]=3 41 B19R2.13525 NC(=O)Nc1ccccc1NCc2ccccn2 7d3911b1e240332e0bb5ade9510a2180 [0,0,1,0,0,0|2,0,1]=4 42 B19R2.13525 NC(=O)Nc1ccccc1NCc2cccnc2 36a43784c548bdea1f7e7a09c856cae9 [0,0,1,0,0,0|2,0,1]=4 43 B19R2.13525 NC(=O)Nc1ccccc1NCc2ccncc2 df86d30cf32709d16f60e1e99ed7a9bf [0,0,1,0,0,0|2,0,1]=4 44 B19R2.13525 NC(=S)Nc1ccccc1NCc2ccccc2 29911f30b5d03038a9fef3e5e5432318 [0,0,1,0,0,0|1,1,1]=4 45 B19R2.13525 NC(=S)Nc1ccccc1OCc2ccccc2 5312740ecff747e7323f3375918bc74d [0,0,1,0,0,0|1,1,1]=4 46 B19R3.629728 CC(=O)N1c2ccccc2Cc3c1cccc3 3d569ae30fed503876639f714f6b35b5 [0,0,0,0,1,0|1,0,1]=3 47 B19R3.629728 CC(=O)N1c2ccccc2Oc3c1cccc3 530546eab2289a48bbf494b2d9ba7009 [0,0,0,0,1,0|2,0,0]=3 48 B19R3.629728 CC(=O)N1c2ccccc2Oc3c1ccnc3 55a3655b3d3a7768740da8985b2c9ccb [0,0,0,0,1,0|3,0,0]=4 49 B19R3.629728 CC(=O)N1c2ccccc2Sc3c1cccc3 fb23c343c1dc91b178ad19908f77d999 [0,0,0,0,1,0|2,0,0]=3 50 B19R3.629728 CC(=O)N1c2ccccc2Sc3c1nccc3 562279a1d7cf21d6553434449579da40 [0,0,0,0,1,0|3,0,0]=4 51 B21R3.7941467 CC(=O)N1Cc2ccccc2/C=C\c3c1cccc3 d5a8c219a5848280421befc691643757 [0,0,0,0,0,1|1,0,0]=2 52 B21R3.7941467 CC(=O)N1Cc2ccccc2C#Cc3c1cccc3 7c8d61fa84bc3937f2b955e641739afe [0,0,0,0,0,1|1,0,2]=4 53 B21R3.7941467 CC(=O)N1Cc2ccccc2C=Cc3c1cccc3 43c2dd25d1527fcde2c90d5388e16c3c [0,0,0,0,0,1|1,0,0]=2 54 B21R3.7941467 CC(=O)N1Cc2ccccc2CCc3c1cccc3 a555ca87053f3162c5afe6ae0433f89a [0,0,0,0,0,1|1,0,2]=4 55 B21R3.7941467 CC(C)N1Cc2ccccc2/C=C\c3c1cccc3 8f60b34fff3c2ad839823a6efe45587b [0,0,0,0,0,1|2,0,1]=4 56 B21R3.7941467 CC(C)N1Cc2ccccc2C=Cc3c1cccc3 e9e1a2c2e031e26b00df292e0577dee5 [0,0,0,0,0,1|2,0,1]=4 57 B21R3.7993561 CC(C)CN1c2ccccc2C=Cc3c1cccc3 86cd47f0456ecb5c21febd058d6b2334 [0,0,0,0,0,1|2,0,1]=4 58 B21R3.7993561 CC(O)CN1c2ccccc2C=Cc3c1cccc3 df3f554174fa679e26eaa0ef9c194a6c [0,0,0,0,0,1|1,0,2]=4 59 B21R3.7993561 CN(C)CN1c2ccccc2C=Cc3c1cccc3 d30bad72ed0768a99398adac2aa81f5d [0,0,0,0,0,1|3,0,0]=4 60 B21R3.7993561 C[C@H](O)CN1c2ccccc2C=Cc3c1cccc3 2f30825e3a3503459ffac9c611ebdefd [0,0,0,0,0,1|1,0,2]=4 61 B21R3.7993561 FC(F)CN1c2ccccc2C=Cc3c1cccc3 35df839f43ec0ea8ab5936938de919f8 [0,0,0,0,0,1|2,0,1]=4 62 B21R3.7993561 NC(=O)CN1c2ccccc2C=Cc3c1cccc3 12b082435ae7d6557a929b9841bfbcf6 [0,0,0,0,0,1|0,0,0]=1 63 B21R3.7993561 NC(=O)CN1c2ccccc2CCc3c1cccc3 57dd0687eb482696df1fd82841f64ba3 [0,0,0,0,0,1|0,0,2]=3 64 B21R3.7993561 NC(=O)CN1c2ccccc2COc3c1cccc3 36e717c174b29d53c67cfefa12294973 [0,0,0,0,0,1|1,0,1]=3 65 B21R3.7993561 O=C(O)CN1c2ccccc2C=Cc3c1cccc3 deb4252b55c48098f658bdb84cb29a6d [0,0,0,0,0,1|1,0,0]=2 66 B21R3.7993561 O=C(O)CN1c2ccccc2CCc3c1cccc3 f89a5a1aa01fec9e7f7d3b15387bc7a6 [0,0,0,0,0,1|1,0,2]=4 67 B21R3.7993561 O=C(O)CN1c2ccccc2COc3c1cccc3 a3a27dce647550adf7bc3176c5c7b2d5 [0,0,0,0,0,1|2,0,1]=4 68 B21R3.7993561 O=[N+]([O-])CN1c2ccccc2C=Cc3c1cccc3 184942bb8408fe3c94090f35d255735b [0,0,0,0,0,1|2,0,0]=3 69 B18R2.10799 Cc1ccccc1N(C=O)c2ccccc2C 238d09ecdbff10338eba68647e65acb6 [1,0,1,0,0,0|0,0,2]=4 70 B18R2.10799 O=CN(c1ccccc1Br)c2ccccc2Br 842508f1aa1c10750b3d17c480152801 [1,0,1,0,0,0|2,0,0]=4 71 B18R2.2627 O=CNc1ccccc1/C=C/c2ccncc2 e9df03ae8591a58e22dbd59a14607ca7 [1,0,1,0,0,0|1,0,0]=3 72 B18R2.2627 O=CNc1ccccc1NCc2ccccc2 cecaca0207f3f7b4c0027b0ce333b7d3 [1,0,1,0,0,0|1,0,1]=4 73 B18R2.2627 O=CNc1ccccc1OCc2ccccc2 3e8bdc364ec4c954b4e8bc88f551d731 [1,0,1,0,0,0|1,0,1]=4 74 B18R2.2627 O=CNc1ccccc1SCc2ccccc2 3811ef8ef430e4759e04f47cc84f1669 [1,0,1,0,0,0|1,0,1]=4 75 B20R2.8697 Cc1ccccc1CNc2ccccc2NC(=O)N 58fae33cbf401a89f7c1befa4ec7d522 [0,1,1,0,0,0|1,0,1]=4 76 B20R2.8697 NC(=O)Nc1ccccc1NCc2ccccc2Cl 987db4174a0d9f5f266741c03eea0dd4 [0,1,1,0,0,0|1,0,1]=4 77 B20R2.8697 NC(=O)Nc1ccccc1NCc2ccccc2F 985082ff5813095bb7b544c65a071266 [0,1,1,0,0,0|1,0,1]=4 78 B20R2.8697 NC(=O)Nc1ccccc1NCc2ccccc2I 5c5f9491105fc7a1d585cbd15533a240 [0,1,1,0,0,0|1,0,1]=4 79 B20R2.8697 NC(=O)Nc1ccccc1NCc2ccccc2O 50427cd17ff721659f9adf0540d50e76 [0,1,1,0,0,0|1,0,1]=4 80 B20R2.15830 Cc1ccc(cc1)CNc2ccccc2NC(=O)N 9191367b047ed0fdaa987f3d03b344e8 [0,1,1,0,0,0|1,0,1]=4 81 B20R2.15830 NC(=O)Nc1ccccc1NCc2ccc(cc2)Br 99d2a6a34a4eaee0adaf9a930b2280d4 [0,1,1,0,0,0|1,0,1]=4 82 B20R2.15830 NC(=O)Nc1ccccc1NCc2ccc(cc2)Cl fcc9eabf54d4ad3c7bd7beb5f08efc18 [0,1,1,0,0,0|1,0,1]=4 83 B20R2.15830 NC(=O)Nc1ccccc1NCc2ccc(cc2)F a9642d1394514898529a63eed5fd24af [0,1,1,0,0,0|1,0,1]=4 84 B20R2.15830 NC(=O)Nc1ccccc1NCc2ccc(cc2)I ae1cc1f40724e29494b80c9e90cdacb2 [0,1,1,0,0,0|1,0,1]=4 85 B20R2.15830 NC(=O)Nc1ccccc1NCc2ccc(cc2)O a2ea31c4a3fe4d7095d39ab29fc7fb30 [0,1,1,0,0,0|1,0,1]=4 86 B20R2.17795 CC(=O)Nc1ccccc1C(=O)Cc2ccccc2 0c847e7844efa6b797c268e503fc2b43 [0,1,1,0,0,0|1,0,1]=4 87 B20R2.17795 NC(=O)Cc1ccccc1C(=O)Nc2ccccc2 4f9806d7fbb32ccaecd16d1bd4739945 [0,1,1,0,0,0|2,0,0]=4 88 B20R2.17804 CC(=O)Nc1ccccc1NC(=O)c2ccccc2 97416ed2f12be4f227c69dfc073dcf23 [0,1,1,0,0,0|2,0,0]=4 89 B20R2.17804 NC(=O)Nc1ccccc1NC(=O)c2ccccc2 6be612e44f34769efd2cffdbcb45742f [0,1,1,0,0,0|1,0,0]=3 90 B20R2.17804 NC(=O)Nc1ccccc1NC(=O)c2ccccn2 7d0afd9a6562d1a97a5edfb0e8c148f1 [0,1,1,0,0,0|2,0,0]=4 91 B20R2.17804 NC(=O)Nc1ccccc1NC(=O)c2cccnc2 43806a89c02b50bfcd5a13e1bddbb6b5 [0,1,1,0,0,0|2,0,0]=4 92 B20R2.17804 NC(=O)Nc1ccccc1NC(=O)c2ccncc2 3c2375c75510ad49ed932e497c89dfca [0,1,1,0,0,0|2,0,0]=4 93 B20R2.17804 NC(=S)Nc1ccccc1NC(=O)c2ccccc2 ad56af8d733632b399ba84651dc6209d [0,1,1,0,0,0|1,1,0]=4 94 B20R2.76279 NC(=O)Nc1cc(ccc1OCc2ccccc2)Cl 86448184d0db01cf8a539724d7951119 [0,1,1,0,0,0|1,0,1]=4 95 B20R2.153665 Cc1cccc(c1)CNc2ccccc2NC(=O)N e4fef4e42829e3b37cd3eef3ab86ecc5 [0,1,1,0,0,0|1,0,1]=4 96 B20R2.153665 NC(=O)Nc1ccccc1NCc2cccc(c2)Br 5031dcac95180b5b3bd0e8ea2c6d738c [0,1,1,0,0,0|1,0,1]=4 97 B20R2.153665 NC(=O)Nc1ccccc1NCc2cccc(c2)Cl 949d0a65a8a83d373c1c5b31b98cce92 [0,1,1,0,0,0|1,0,1]=4 98 B20R2.153665 NC(=O)Nc1ccccc1NCc2cccc(c2)F adf7c9766f3eb0457334ecf9dac245a5 [0,1,1,0,0,0|1,0,1]=4 99 B20R2.153665 NC(=O)Nc1ccccc1NCc2cccc(c2)I 9f49c7c7acd43d0e97bf28cca386a48f [0,1,1,0,0,0|1,0,1]=4 100 B20R2.153665 NC(=O)Nc1ccccc1NCc2cccc(c2)O 5c9a5e66a33aaf716bc04762e467a3c7 [0,1,1,0,0,0|1,0,1]=4 101 B20R2.331049 C#CC(=O)Nc1ccccc1/C=C/c2ccncc2 23bd25168af8c2543b4da5c80c72198d [0,1,1,0,0,0|2,0,0]=4 102 B20R2.331049 C#CC(=O)Nc1cccnc1/C=C/c2ccccc2 029f6e03c8d1b6f0750e896506d30912 [0,1,1,0,0,0|2,0,0]=4 103 B20R2.331049 C=CC(=O)Nc1ccccc1/C=C/c2ccncc2 8aa92d98163f97425038e85dc88a7464 [0,1,1,0,0,0|2,0,0]=4 104 B20R2.331049 CCC(=O)Nc1ccccc1/C=C/c2ccncc2 9f529917265d6d87e5733e6354aeb22d [0,1,1,0,0,0|2,0,0]=4 105 B20R2.331049 O=C(CF)Nc1ccccc1/C=C/c2ccncc2 aa2b913745f9dcce3ef3f14e03ab800e [0,1,1,0,0,0|2,0,0]=4 106 B20R2.331049 O=C(CO)Nc1ccccc1/C=C/c2ccncc2 496052ab9adc21d85ff8508e2378952b [0,1,1,0,0,0|2,0,0]=4 107 B20R2.331049 O=C(CS)Nc1ccccc1/C=C/c2ccncc2 0e4362cde0608764aa96c8eee1f7c44b [0,1,1,0,0,0|2,0,0]=4 108 B20R2.331049 O=CC(=O)Nc1ccccc1/C=C/c2ccncc2 b1536c6102e6570eaf448560d93a7427 [0,1,1,0,0,0|2,0,0]=4 109 B20R2.331049 O=CC(=O)Nc1cccnc1/C=C/c2ccccc2 549b3d304a049ac386956b9a38074efa [0,1,1,0,0,0|2,0,0]=4 110 B20R2.18215 C=Cc1ccccc1N(c2ccccc2)C(C)C=O 5ceb29c6c6211575387efc02394c7433 [0,1,1,0,0,0|1,0,1]=4 111 B20R3.178278 C#CCN1c2ccccc2C=Cc3c1cccc3 9d95ef81eefb3e4ae028cfa9266f61dd [1,1,0,0,0,0|1,0,1]=4 112 B20R3.178278 C=CCN1c2ccccc2C=Cc3c1cccc3 6e2750b4a545160870ec39bcdca97f74 [1,1,0,0,0,0|1,0,0]=3 113 B20R3.178278 CCCN1c2ccccc2C=Cc3c1cccc3 23a41169d094c78ef78ca3347efc0b64 [1,1,0,0,0,0|1,0,1]=4 114 B20R3.178278 COCN1c2ccccc2C=Cc3c1cccc3 e8aecd6f7d7e34c5ea84e6fe5d809aaf [1,1,0,0,0,0|0,0,2]=4 115 B20R3.178278 CSCN1c2ccccc2C=Cc3c1cccc3 7f3eef45b953cd53b38d629cf976543d [1,1,0,0,0,0|0,1,1]=4 116 B20R3.178278 FCCN1c2ccccc2C=Cc3c1cccc3 9006c82095ceb8934d006a6aba16de77 [1,1,0,0,0,0|1,0,1]=4 117 B20R3.178278 N#CCN1c2ccccc2C=Cc3c1cccc3 9a5d7c0e3bdd357f0c5e38612cc12402 [1,1,0,0,0,0|0,0,2]=4 118 B20R3.178278 O=CCN1c2ccccc2C=Cc3c1cccc3 edc31b6fbae2d5558c2384adb7feaa40 [1,1,0,0,0,0|0,0,0]=2 119 B20R3.178278 O=CCN1c2ccccc2CCc3c1cccc3 25381d3cdcfaa4ca09bc818ce8a48905 [1,1,0,0,0,0|0,0,2]=4 120 B20R3.178278 O=CCN1c2ccccc2COc3c1cccc3 e6453f6e3c51fffba0bfd75105122848 [1,1,0,0,0,0|1,0,1]=4 121 B20R3.178278 OCCN1c2ccccc2C=Cc3c1cccc3 191c0e3d2c69f9134ae5dc68f389af50 [1,1,0,0,0,0|0,0,2]=4 122 B20R3.178278 SCCN1c2ccccc2C=Cc3c1cccc3 a7ceb092658187da44e07c3919e79b15 [1,1,0,0,0,0|0,1,1]=4 123 B20R3.8057591 O=CN1c2ccccc2C(=O)Nc3c1nccc3 6a5bf66c04bb604ac2bc7f717cf2317d [1,1,0,0,0,0|2,0,0]=4 124 B20R3.8057591 O=CN1c2ccccc2CC(=O)c3c1cccc3 d9b83d80bebb48772a0c9199feb7997f [1,1,0,0,0,0|0,0,1]=3 125 B20R3.8057591 O=CN1c2ccccc2CC(c3c1cccc3)O 2c559fa3d6860dc97db17046db4b7ae4 [1,1,0,0,0,0|0,0,2]=4 126 B20R3.8057591 O=CN1c2ccccc2NC(=O)c3c1cccc3 1b4da0daeb5521a2276db0d917506122 [1,1,0,0,0,0|1,0,0]=3 127 B20R3.8057591 O=CN1c2ccccc2NC(=O)c3c1nccc3 7f74de689c4598655f22d733147258f2 [1,1,0,0,0,0|2,0,0]=4 128 B20R3.11403650 O=CN1c2ccccc2CCc3c1cc(cc3)Cl 2e92355a1a48f7d0b398cdb975e233ce [1,1,0,0,0,0|0,0,2]=4 129 B20R3.5858 CC(=O)N1c2ccccc2Oc3c1ccc(c3)Br f5ccc5352199a5285ed696ab4ae51e6e [0,1,0,0,1,0|2,0,0]=4 130 B20R3.5858 CC(=O)N1c2ccccc2Sc3c1ccc(c3)F 9eb363bb718f4c3c690f5f4b5141a4c6 [0,1,0,0,1,0|2,0,0]=4 131 B20R3.5858 CC(=O)N1c2ccccc2Sc3c1ccc(c3)O c3a57720285db34817e1e91d02f4f022 [0,1,0,0,1,0|2,0,0]=4 132 B20R3.143064 CC(=O)N1c2ccccc2Sc3c1cc(cc3)Cl a4647593e0378af490ec6b48b954178d [0,1,0,0,1,0|2,0,0]=4 133 B20R3.143064 CC(=O)N1c2ccccc2Sc3c1cc(cc3)F 6bd053810a81b65b3bf5488de7d45eb0 [0,1,0,0,1,0|2,0,0]=4 134 B20R3.251403 CC(=O)N1c2ccccc2Sc3c1cccc3Cl 0643404e64471f172f6819fc599fca23 [0,1,0,0,1,0|2,0,0]=4 135 B20R3.251567 CC(=O)N1c2ccccc2Sc3c1c(ccc3)Cl ffb3e7baf254916912d66bcd5676ac21 [0,1,0,0,1,0|2,0,0]=4 136 B20R3.3482734 CC(=O)N1c2ccccc2S(=O)c3c1cccc3 3081d671abb1477cd96904faba20c106 [0,1,0,0,1,0|2,0,0]=4 137 B20R3.5877517 C#CC(=O)N1c2ccccc2Cc3c1cccc3 ec11e5e2fc8e48f8eec13797823b27cd [0,1,0,0,1,0|1,0,1]=4 138 B20R3.5877517 C#CC(=O)N1c2ccccc2Oc3c1cccc3 8f0643957ae278216222cb73720d987b [0,1,0,0,1,0|2,0,0]=4 139 B20R3.5877517 C#CC(=O)N1c2ccccc2Sc3c1cccc3 3c7560ee5369e84d18284d33eb97d238 [0,1,0,0,1,0|2,0,0]=4 140 B20R3.5877517 C=CC(=O)N1c2ccccc2Cc3c1cccc3 6ab20d8983d8df61ce4dbc1fcf5a2f9b [0,1,0,0,1,0|1,0,1]=4 141 B20R3.5877517 C=CC(=O)N1c2ccccc2Oc3c1cccc3 09c0a2a8f0340cbab60f0e0657f57857 [0,1,0,0,1,0|2,0,0]=4 142 B20R3.5877517 C=CC(=O)N1c2ccccc2Sc3c1cccc3 bcc92f159eaaf930f89f96d62f31bca0 [0,1,0,0,1,0|2,0,0]=4 143 B20R3.5877517 CCC(=O)N1c2ccccc2Sc3c1cccc3 8b8bd6c9f2bb4f458edc9f666e506574 [0,1,0,0,1,0|2,0,0]=4 144 B20R3.5877517 O=C(CF)N1c2ccccc2Oc3c1cccc3 35e07ff09b14535f9afa47e9c59ea917 [0,1,0,0,1,0|2,0,0]=4 145 B20R3.5877517 O=C(CF)N1c2ccccc2Sc3c1cccc3 5e967fae4b9fda52276806307d0e20d5 [0,1,0,0,1,0|2,0,0]=4 146 B20R3.5877517 O=C(CO)N1c2ccccc2Sc3c1cccc3 30343018613a7361172d65a6d95a1ae9 [0,1,0,0,1,0|2,0,0]=4 147 B20R3.5877517 O=CC(=O)N1c2ccccc2Cc3c1cccc3 20604a8245c0fec938419d6e5ee454e8 [0,1,0,0,1,0|1,0,1]=4 148 B20R3.5877517 O=CC(=O)N1c2ccccc2Oc3c1cccc3 93d984edfb6f90036053c3ed173a963b [0,1,0,0,1,0|2,0,0]=4 149 B20R3.5877517 O=CC(=O)N1c2ccccc2Sc3c1cccc3 55210c00aff2e90bbea4889bb0314968 [0,1,0,0,1,0|2,0,0]=4 150 B22R3.15676912 C#CC(=O)N1Cc2ccccc2/C=C\c3c1cccc3 80255adc1572ee9a60bb595d61d509cb [0,1,0,0,0,1|1,0,0]=3 151 B22R3.15676912 C#CC(=O)N1Cc2ccccc2C=Cc3c1cccc3 f79fec6056e667931e1babfc4774296e [0,1,0,0,0,1|1,0,0]=3 152 B22R3.15676912 C=CC(=O)N1Cc2ccccc2/C=C\c3c1cccc3 2d9d10452925b441c89f4ec25880a7d8 [0,1,0,0,0,1|1,0,0]=3 153 B22R3.15676912 C=CC(=O)N1Cc2ccccc2C=Cc3c1cccc3 6914e4af4c104d2a87bf7dbf4668adf2 [0,1,0,0,0,1|1,0,0]=3 154 B22R3.15676912 CC(C=O)N1Cc2ccccc2/C=C\c3c1cccc3 306446ae6cf93c3e048c300fa99bdd9c [0,1,0,0,0,1|1,0,1]=4 155 B22R3.15676912 CC(C=O)N1Cc2ccccc2C=Cc3c1cccc3 d261e0f19e2e61c46823dccc2af3ce94 [0,1,0,0,0,1|1,0,1]=4 156 B22R3.15676912 CCC(=O)N1Cc2ccccc2/C=C\c3c1cccc3 f970896c8f764502ae4a60df4472f656 [0,1,0,0,0,1|1,0,0]=3 157 B22R3.15676912 CCC(=O)N1Cc2ccccc2C=Cc3c1cccc3 42f7af4775aaf0c475ad22b5d758a297 [0,1,0,0,0,1|1,0,0]=3 158 B22R3.15676912 C[C@H](C=O)N1Cc2ccccc2/C=C\c3c1cccc3 78c66b1f9cf191576a3af208d8fc1b7e [0,1,0,0,0,1|1,0,1]=4 159 B22R3.15676912 C[C@H](C=O)N1Cc2ccccc2C=Cc3c1cccc3 51ca888baddf0573a0f1b2b438616cd7 [0,1,0,0,0,1|1,0,1]=4 160 B22R3.15676912 O=C(CF)N1Cc2ccccc2/C=C\c3c1cccc3 ce0cd3a3a50d42990c3fd1ef4b09138b [0,1,0,0,0,1|1,0,0]=3 161 B22R3.15676912 O=C(CF)N1Cc2ccccc2C=Cc3c1cccc3 50fe74135d8836bd4134502abc136b47 [0,1,0,0,0,1|1,0,0]=3 162 B22R3.15676912 O=C(CO)N1Cc2ccccc2/C=C\c3c1cccc3 21d3e0cd580af7b24fb8baf0c5de3bc7 [0,1,0,0,0,1|1,0,0]=3 163 B22R3.15676912 O=C(CO)N1Cc2ccccc2C=Cc3c1cccc3 ff9383d9ba0626bb52f0064e64a6e362 [0,1,0,0,0,1|1,0,0]=3 164 B22R3.15676912 O=CC(=O)N1Cc2ccccc2/C=C\c3c1cccc3 987b943022a57cb8351a9095bf80a37d [0,1,0,0,0,1|1,0,0]=3 165 B22R3.15676912 O=CC(=O)N1Cc2ccccc2C=Cc3c1cccc3 6964db9146fda1346fca4cc01eeec7fc [0,1,0,0,0,1|1,0,0]=3 166 B22R3.5488262 NC(=O)CN1c2ccccc2CCc3c1cc(cc3)Cl 0fd6fa3d3892fda48fda338bfef4942c [0,1,0,0,0,1|0,0,2]=4 167 B22R3.10609676 NC(=O)CN1c2ccccc2C(=O)Nc3c1nccc3 e104f4dca2870c3faf7b5003eb5e84f7 [0,1,0,0,0,1|2,0,0]=4 168 B22R3.10609676 NC(=O)CN1c2ccccc2CC(=O)c3c1cccc3 f8ff7c2a9ad7f6acd4c9d5af00672b9b [0,1,0,0,0,1|0,0,1]=3 169 B22R3.10609676 NC(=O)CN1c2ccccc2CC(c3c1cccc3)O 14a252fc9d11e12739f07d5265769201 [0,1,0,0,0,1|0,0,2]=4 170 B22R3.10609676 NC(=O)CN1c2ccccc2NC(=O)c3c1cccc3 20f8d97a76460354eb42c2770abbc066 [0,1,0,0,0,1|1,0,0]=3 171 B22R3.10609676 NC(=O)CN1c2ccccc2NC(=O)c3c1nccc3 bff0f90e4b642e96f654a11d5c5d309a [0,1,0,0,0,1|2,0,0]=4 172 B22R3.10609676 O=C(O)CN1c2ccccc2CC(=O)c3c1cccc3 21cc8a67e83bcbe86b82b38ffa5da36f [0,1,0,0,0,1|1,0,1]=4 173 B22R3.10609676 O=C(O)CN1c2ccccc2NC(=O)c3c1cccc3 ec9dbc5dd09dfba5134697aac0b76f42 [0,1,0,0,0,1|2,0,0]=4 174 B22R3.15879546 C=C(C#N)CN1c2ccccc2C=Cc3c1cccc3 9ad5cd3418bcb0830057390536c42316 [0,1,0,0,0,1|1,0,1]=4 175 B22R3.15879546 C=C(C=O)OC1c2ccccc2C=Cc3c1cccc3 84b9fe0026f49beb0650b09aa9f5ab4b [0,1,0,0,0,1|2,0,0]=4 176 B22R3.15879546 C=C(CN1c2ccccc2C=Cc3c1cccc3)OC abe183811c14a01b7f66e6e9b4a43df6 [0,1,0,0,0,1|1,0,1]=4 177 B22R3.15879546 CCC(=O)CN1c2ccccc2C=Cc3c1cccc3 e5568ff31e6969381f82f1942047bcad [0,1,0,0,0,1|1,0,0]=3 178 B22R3.15879546 CNC(=O)CN1c2ccccc2C=Cc3c1cccc3 af370e084abe875e2ce1b89cfe9cbbee [0,1,0,0,0,1|0,0,0]=2 179 B22R3.15879546 CNC(=O)CN1c2ccccc2CCc3c1cccc3 bc0fb3d319949140e0da1e3d0c3ad70e [0,1,0,0,0,1|0,0,2]=4 180 B22R3.15879546 CNC(=O)CN1c2ccccc2COc3c1cccc3 9568682b81ccab8c00211c8ab2f4ce30 [0,1,0,0,0,1|1,0,1]=4 181 B22R3.15879546 COC(=O)CN1c2ccccc2C=Cc3c1cccc3 23dbf913eb8a17f555ca8452a5aef7fc [0,1,0,0,0,1|1,0,0]=3 182 B22R3.15879546 Cl/C=C(\Cl)/CN1c2ccccc2C=Cc3c1cccc3 5dcb0447c584285a5b74dc048aec9bb6 [0,1,0,0,0,1|2,0,0]=4 183 B22R3.23420983 C=C(Br)C(=O)N1c2ccccc2C=Cc3c1cccc3 350e9b9d9ef5415eb1ae25ffb81add2f [0,1,0,0,0,1|2,0,0]=4 184 B22R3.23420983 C=C(C)C(=O)N1c2ccccc2C=Cc3c1cccc3 00b20a35045746cc0a5e144b60ad1705 [0,1,0,0,0,1|2,0,0]=4 185 B22R3.23420983 C=C(Cl)C(=O)N1c2ccccc2C=Cc3c1cccc3 7c5699d17a8c0a5a598cc3e895d98768 [0,1,0,0,0,1|2,0,0]=4 186 B22R3.23420983 C=C(F)C(=O)N1c2ccccc2C=Cc3c1cccc3 e893a8067e83ca650da82a9ca497dfd0 [0,1,0,0,0,1|2,0,0]=4 187 B22R3.23420983 CC(=O)C(=O)N1c2ccccc2C=Cc3c1cccc3 7b7ddc58732dce45f197e21a17fe9475 [0,1,0,0,0,1|1,0,0]=3 188 B22R3.23420983 NC(=O)C(=O)N1c2ccccc2C=Cc3c1cccc3 b2bc31e82b8373ae42edab1559521172 [0,1,0,0,0,1|0,0,0]=2 189 B22R3.23420983 NC(=O)C(=O)N1c2ccccc2CCc3c1cccc3 2e17527f4197a28f97f3238f762b418a [0,1,0,0,0,1|0,0,2]=4 190 B22R3.23420983 NC(=O)C(=O)N1c2ccccc2COc3c1cccc3 47a6268e2428e4c1d1de88fd2b216780 [0,1,0,0,0,1|1,0,1]=4 191 B22R3.25110239 CS(=O)(=O)CN1c2ccccc2C=Cc3c1cccc3 7f1fd6f75550936710e0d8db05d28487 [0,1,0,0,0,1|2,0,0]=4 192 B22R3.259069 CC(=O)N1c2ccccc2NC(=O)c3c1ccc(c3)Br 8a6ac45d26b5c41a0aae041b7df2c83a [0,2,0,0,0,0|2,0,0]=4 193 B22R3.259069 CC(=O)N1c2ccccc2NC(=O)c3c1ccc(c3)F 6ac02e82b9e70d0a71351463489317c1 [0,2,0,0,0,0|2,0,0]=4 194 B22R3.259670 CC(=O)N1c2ccc(cc2NC(=O)c3c1cccc3)Cl 278d98ec007984f3643927887079b3c5 [0,2,0,0,0,0|2,0,0]=4 195 B22R3.661893 CC(=O)N1c2ccccc2NC(=O)c3c1cc(cc3)Br 194ebecf6e676505391f0db8ce14fb0a [0,2,0,0,0,0|2,0,0]=4 196 B22R3.17329053 COC1=Cc2ccccc2N(c3c1cccc3)C(=O)C 33c9caad5043f58441f42e93b1ea36b4 [0,2,0,0,0,0|1,0,0]=3 197 B22R3.99401895 C#CC(=O)N1c2ccccc2CC(=O)c3c1cccc3 98c4e0ed34c9237aa7faeb296199c8f3 [0,2,0,0,0,0|1,0,1]=4 198 B22R3.99401895 C#CC(=O)N1c2ccccc2NC(=O)c3c1cccc3 a48d8b62c3273ab193ed4e869960e04f [0,2,0,0,0,0|2,0,0]=4 199 B22R3.99401895 C=CC(=O)N1c2ccccc2CC(=O)c3c1cccc3 0779e7b6be0ecafc6a1675f9bb951dc5 [0,2,0,0,0,0|1,0,1]=4 200 B22R3.99401895 C=CC(=O)N1c2ccccc2NC(=O)c3c1cccc3 5de856cf77b5590e194f2ca8aa1b0cf3 [0,2,0,0,0,0|2,0,0]=4 201 B22R3.99401895 CCC(=O)N1c2ccccc2CC(=O)c3c1cccc3 078ebdbb42e63ef6b67806b8a1a93a53 [0,2,0,0,0,0|1,0,1]=4 202 B22R3.99401895 CCC(=O)N1c2ccccc2NC(=O)c3c1cccc3 499e04ec46fcfcebb9cef5bd2ddaeb98 [0,2,0,0,0,0|2,0,0]=4 203 B22R3.99401895 O=C1Cc2ccccc2N(c3c1cccc3)C(=O)CF 45bf0dde5b8dfed6acda6af04bf21f05 [0,2,0,0,0,0|1,0,1]=4 204 B22R3.99401895 O=C1Cc2ccccc2N(c3c1cccc3)C(=O)CO 09795c049d0782b78820e43326f7bcc2 [0,2,0,0,0,0|1,0,1]=4 205 B22R3.99401895 O=C1Cc2ccccc2N(c3c1cccc3)C(=O)CS 43f29b2db7a06efa01e256fe762a74df [0,2,0,0,0,0|1,0,1]=4 206 B22R3.99401895 O=C1Nc2ccccc2N(c3c1cccc3)C(=O)CF 390263c2f851af97b34f8a30be19745b [0,2,0,0,0,0|2,0,0]=4 207 B22R3.99401895 O=C1Nc2ccccc2N(c3c1cccc3)C(=O)CO 49276820da5f2a9ec3c2443ebb4cafe7 [0,2,0,0,0,0|2,0,0]=4 208 B22R3.99401895 O=C1Nc2ccccc2N(c3c1cccc3)C(=O)CS af61439c4b4b0cd9984ad8fba1bf9f07 [0,2,0,0,0,0|2,0,0]=4 209 B22R3.99401895 O=CC(=O)N1c2ccccc2CC(=O)c3c1cccc3 aad32cb2556b2d04a612f55faad95623 [0,2,0,0,0,0|1,0,1]=4 210 B22R3.99401895 O=CC(=O)N1c2ccccc2NC(=O)c3c1cccc3 ce10686726fe024390ce7684851a432b [0,2,0,0,0,0|2,0,0]=4 211 B22R3.11999048 CCC(C=O)N1c2ccccc2C=Cc3c1cccc3 54fb7398028bd7b77f7a407841f76f87 [0,2,0,0,0,0|1,0,1]=4 212 B22R3.11999048 N#CC(C=O)N1c2ccccc2C=Cc3c1cccc3 a78a26e3afb62a4213dec945f9b29523 [0,2,0,0,0,0|0,0,2]=4 213 B22R3.11999048 O=CC(C=O)N1c2ccccc2C=Cc3c1cccc3 2541b71fff5dfd3ad2cb8385769705f9 [0,2,0,0,0,0|1,0,1]=4 214 B22R3.13446522 C#CCC(=O)N1c2ccccc2C=Cc3c1cccc3 a678f0a85e6279c80d7971c395500d8d [0,2,0,0,0,0|1,0,0]=3 215 B22R3.13446522 C/C=C/C(=O)N1c2ccccc2C=Cc3c1cccc3 fac67d4d4de4ef251f874e0a309596c5 [0,2,0,0,0,0|1,0,0]=3 216 B22R3.13446522 C=CCC(=O)N1c2ccccc2C=Cc3c1cccc3 47f8094319d7379ec22421535e56b692 [0,2,0,0,0,0|1,0,0]=3 217 B22R3.13446522 CC#CC(=O)N1c2ccccc2C=Cc3c1cccc3 486189fb4497bf1b55aab6470542541b [0,2,0,0,0,0|1,0,0]=3 218 B22R3.13446522 CCCC(=O)N1c2ccccc2C=Cc3c1cccc3 df28532757bbd3d376cdeaea172eff60 [0,2,0,0,0,0|1,0,0]=3 219 B22R3.13446522 COCC(=O)N1c2ccccc2C=Cc3c1cccc3 12c25fa6765de80f0aa6c3d761ce012d [0,2,0,0,0,0|1,0,0]=3 220 B22R3.13446522 CSCC(=O)N1c2ccccc2C=Cc3c1cccc3 9ae810661eed68ad0f6aa0e9e1c0f47f [0,2,0,0,0,0|1,0,0]=3 221 B22R3.13446522 N#CCC(=O)N1c2ccccc2C=Cc3c1cccc3 a48e6844e66dcd8beb950c4772e85591 [0,2,0,0,0,0|0,0,1]=3 222 B22R3.13446522 NOCC(=O)N1c2ccccc2C=Cc3c1cccc3 3a0ad9f5da2609d7a0d460a7bf83d691 [0,2,0,0,0,0|0,0,0]=2 223 B22R3.13446522 NOCC(=O)N1c2ccccc2CCc3c1cccc3 96dc490315a304b39caa7cf4d5bf23d7 [0,2,0,0,0,0|0,0,2]=4 224 B22R3.13446522 NOCC(=O)N1c2ccccc2COc3c1cccc3 f9da708c2475e55e81b2662603b872f0 [0,2,0,0,0,0|1,0,1]=4 225 B22R3.13446522 O=C(/C=C/Br)N1c2ccccc2C=Cc3c1cccc3 1d40ed5bb3fbbc33293af83321582725 [0,2,0,0,0,0|1,0,0]=3 226 B22R3.13446522 O=C(/C=C/Cl)N1c2ccccc2C=Cc3c1cccc3 c3a3bbff99aafdebbe6e01d6cc770e3d [0,2,0,0,0,0|1,0,0]=3 227 B22R3.13446522 O=C(/C=C/I)N1c2ccccc2C=Cc3c1cccc3 838190ccc6c4e7bf2a94041b7ea5afc4 [0,2,0,0,0,0|1,0,0]=3 228 B22R3.13446522 O=C(/C=C\Br)N1c2ccccc2C=Cc3c1cccc3 96f36516bed2de7a1b5e3d52c495f543 [0,2,0,0,0,0|1,0,0]=3 229 B22R3.13446522 O=C(/C=C\Cl)N1c2ccccc2C=Cc3c1cccc3 c9bdc4ba062577f74765c7252c2301ec [0,2,0,0,0,0|1,0,0]=3 230 B22R3.13446522 O=C(/C=C\I)N1c2ccccc2C=Cc3c1cccc3 4222fbb0bb3dccc20612db95d47add9f [0,2,0,0,0,0|1,0,0]=3 231 B22R3.13446522 O=C(C#CBr)N1c2ccccc2C=Cc3c1cccc3 6f2e4af92d90cecbfcdae95e66983252 [0,2,0,0,0,0|1,0,0]=3 232 B22R3.13446522 O=C(C=CBr)N1c2ccccc2C=Cc3c1cccc3 acfecf1f803d5bbd04d398f8cbcf578b [0,2,0,0,0,0|1,0,0]=3 233 B22R3.13446522 O=C(C=CI)N1c2ccccc2C=Cc3c1cccc3 e6ec86ff281c19c7574a441729f46057 [0,2,0,0,0,0|1,0,0]=3 234 B22R3.13446522 O=C(CCF)N1c2ccccc2C=Cc3c1cccc3 57d9dbecee782ef89261b83d1fd1a79a [0,2,0,0,0,0|1,0,0]=3 235 B22R3.13446522 O=C(CCO)N1c2ccccc2C=Cc3c1cccc3 cf451f164cfab9eb7f6dbbc10c163168 [0,2,0,0,0,0|1,0,0]=3 236 B22R3.13446522 O=C(CCS)N1c2ccccc2C=Cc3c1cccc3 d59543b9bb6cabf36cb1e5564fb4a840 [0,2,0,0,0,0|1,0,0]=3 237 B22R3.13446522 O=CCC(=O)N1c2ccccc2C=Cc3c1cccc3 633f9f79939630a831e826dfee652aeb [0,2,0,0,0,0|1,0,0]=3 238 B20R3.14321 O=c1[nH]c2cccc(c2[nH]1)NCc3ccccc3 3a5211c6cabc8b42a7e0c5f57d7419da [0,0,1,1,0,0|1,0,1]=4 239 B20R3.14321 O=c1[nH]c2cccc(c2[nH]1)OCc3ccccc3 c737f03d48b632f5ab70eba68108c2cc [0,0,1,1,0,0|1,0,1]=4 240 B20R3.45749 C=Cc1ccccc1c2c([nH]c3c2cccc3)C 242c657f1f9b2523ce20d03e9ba6db82 [0,0,1,1,0,0|2,0,0]=4 241 B18R2.7138 NC(=O)c1ccccc1CNc2ccccc2 d5afe13d691db21f90e26c3b9b10f378 [0,0,1,0,1,0|1,0,1]=4 242 B18R2.7138 NC(=O)c1ccccc1NCc2ccccc2 5cd88e99a47548ce73523d04bd106b5c [0,0,1,0,1,0|1,0,1]=4 243 B18R2.7138 NC(=O)c1ccccc1OCc2ccccc2 876b3f8681f049009c30eaa68ff6f8c6 [0,0,1,0,1,0|1,0,1]=4 244 B18R2.7181 CC(=O)Nc1ccccc1Cc2ccccc2 112ce9eb9f0f8ef8ef37a88fdcf6ecf4 [0,0,1,0,1,0|1,0,1]=4 245 B18R2.7181 CC(=O)Nc1ccccc1Nc2ccccc2 e06cef79b624191d3dd9df90b31c38a2 [0,0,1,0,1,0|2,0,0]=4 246 B18R2.7181 CC(=O)Nc1ccccc1Oc2ccccc2 247246b70f46b666f729adbeb36e1831 [0,0,1,0,1,0|2,0,0]=4 247 B18R2.7181 CC(=O)Nc1ccccc1Sc2ccccc2 3304d2a3ad4b6d46650743287da7bc18 [0,0,1,0,1,0|2,0,0]=4 248 B18R2.7181 NC(=O)Cc1ccccc1Nc2ccccc2 d828b0cd1e5d014b720f3fa29d4e376c [0,0,1,0,1,0|2,0,0]=4 249 B18R2.7181 NC(=O)Nc1ccccc1Nc2ccccc2 4b7599dd10a83076201027866868d9b8 [0,0,1,0,1,0|1,0,0]=3 250 B18R2.7181 NC(=O)Nc1ccccc1Nc2cccnc2 a3fdff4eebd27a67fb37e2047718a21d [0,0,1,0,1,0|2,0,0]=4 251 B18R2.7181 NC(=S)Nc1ccccc1Nc2ccccc2 92c99c5c8cec211e8458679d0d6f8b71 [0,0,1,0,1,0|1,1,0]=4 252 B18R3.220425 O=CN1c2ccccc2Cc3c1cccc3 e565cc67140ebd4708a9151f0c5ca2a7 [1,0,0,0,1,0|0,0,1]=3 253 B18R3.220425 O=CN1c2ccccc2Oc3c1cccc3 8d8528b4f3c411244f305e8fd48bd8a9 [1,0,0,0,1,0|1,0,0]=3 254 B18R3.220425 O=CN1c2ccccc2Oc3c1ccnc3 8392d5557194114e9757a8a89c372584 [1,0,0,0,1,0|2,0,0]=4 255 B18R3.220425 O=CN1c2ccccc2Sc3c1cccc3 be8c2dfb4f5f07d767156d2e4dcb860b [1,0,0,0,1,0|1,0,0]=3 256 B18R3.220425 O=CN1c2ccccc2Sc3c1nccc3 cfe5a2bbe38b275ffbdb132b57fd0857 [1,0,0,0,1,0|2,0,0]=4 257 B20R2.141001 Cc1ccccc1N(CC(=O)N)c2ccccc2C ee54e398d26b5dd6f8f495f0b6cc17ff [0,0,1,0,0,1|0,0,2]=4 258 B20R2.141001 NC(=O)CN(c1ccccc1Br)c2ccccc2Br 1cb8f00edcd2aede0e485612a1d962d2 [0,0,1,0,0,1|2,0,0]=4 259 B20R2.10555 NC(=O)CNc1ccccc1/C=C/c2ccncc2 d88542555ddd46699361b26db22393d3 [0,0,1,0,0,1|1,0,0]=3 260 B20R2.10555 NC(=O)CNc1ccccc1C#Cc2ccccc2 79f184796612dd0edccbea68a948805f [0,0,1,0,0,1|0,0,2]=4 261 B20R2.10555 NC(=O)CNc1ccccc1OCc2ccccc2 c87f2c0802718847d78ff5bd72699f32 [0,0,1,0,0,1|1,0,1]=4 262 B20R2.10555 NC(=O)CNc1ccccc1SCc2ccccc2 4651b0c4b6600c4f67c4aa81c51fd3fd [0,0,1,0,0,1|1,0,1]=4 263 B20R2.10555 NC(=O)CNc1cccnc1/C=C/c2ccccc2 815665d4e2504faf16b98903180d2e5d [0,0,1,0,0,1|1,0,0]=3 264 B20R2.10555 NC(=O)COc1ccccc1/C=C/c2ccccn2 0657af36d678435d764de849f599ac43 [0,0,1,0,0,1|2,0,0]=4 265 B20R2.10555 NC(=O)COc1ccccc1C=Cc2ccccc2 a9fc10cea722555744b20889d7448e55 [0,0,1,0,0,1|1,0,0]=3 266 B20R2.10555 O=C(O)CNc1ccccc1/C=C/c2ccncc2 e7b42fe4428d04b575f44a1f212eff64 [0,0,1,0,0,1|2,0,0]=4 267 B20R2.10555 O=C(O)CNc1cccnc1/C=C/c2ccccc2 dcc98d1bc96f0148076d7ce64ba2d8a8 [0,0,1,0,0,1|2,0,0]=4 268 B20R2.10555 O=C(O)COc1ccccc1C=Cc2ccccc2 81bc39199890b76d27b52697314a1135 [0,0,1,0,0,1|2,0,0]=4 269 B20R2.17796 NC(=O)Nc1ccccc1NCCc2ccccc2 d2c38dca8e7e0f02958cc5519424ae9d [0,0,1,0,0,1|0,0,2]=4 270 B20R2.18223 C=Cc1ccccc1N(CC(=O)N)c2ccccc2 3d0147fa84134e5f6b061027c3c1d527 [0,0,1,0,0,1|0,0,0]=2 271 B20R2.18223 C=Cc1cccnc1N(CC(=O)N)c2ccccc2 37374d66cefcbcaee026dcc02eee0909 [0,0,1,0,0,1|1,0,0]=3 272 B20R2.18223 C=Cc1ncccc1N(CC(=O)N)c2ccccc2 f4062becdd5696f97570daa02aa7a069 [0,0,1,0,0,1|1,0,0]=3 273 B20R2.18223 CCc1ccccc1N(CC(=O)N)c2ccccc2 4f9bb704e316165cc6379fe2a8eb0b6a [0,0,1,0,0,1|0,0,2]=4 274 B20R2.18223 NC(=O)CN(c1ccccc1)c2ccccc2C=O 48c47bd16877a675c522647ea8a58da1 [0,0,1,0,0,1|1,0,0]=3 275 B20R2.18223 NC(=O)CN(c1ccccc1)c2ccccc2CF c09ad1f47e46ba7ce900be713840aaf2 [0,0,1,0,0,1|1,0,1]=4 276 B20R2.18223 NC(=O)CN(c1ccccc1)c2ccccc2CO 45e3f1d3e1d770d3355a642289a52923 [0,0,1,0,0,1|1,0,1]=4 277 B20R2.18223 NC(=O)CN(c1ccccc1)c2cccnc2C=O b0b61f75dd1337439756d4c5484191a7 [0,0,1,0,0,1|2,0,0]=4 278 B20R2.18223 NC(=O)CN(c1ccccc1)c2ccncc2C=O 98e431866235d70a7170c72ca1fc8e1f [0,0,1,0,0,1|2,0,0]=4 279 B20R2.18223 NC(=O)CN(c1ccccc1)c2cnccc2C=O 1435f11547b43f6a133ff88ff9afce84 [0,0,1,0,0,1|2,0,0]=4 280 B20R2.18223 NC(=O)CN(c1ccccc1)c2ncccc2C=O 351442ba3c551b88861784521e0bdcb1 [0,0,1,0,0,1|2,0,0]=4 281 B20R2.290374 C=Cc1ccccc1NC(C(=O)C)c2ccccc2 6fe91e89d9d6b098755adaead0bd94b7 [0,0,1,0,0,1|2,0,0]=4 282 B20R2.290374 C=Cc1ccccc1NC(C(=O)N)c2ccccc2 3751927709c7842b97d529ccbcffd2e3 [0,0,1,0,0,1|1,0,0]=3 283 B20R2.290374 C=Cc1ccccc1NC(C(=O)O)c2ccccc2 259de486f74ebe77c6fa619173b72eb7 [0,0,1,0,0,1|2,0,0]=4 284 B20R2.290374 C=Cc1ccccc1OC(C(=O)C)c2ccccc2 4a5561d65b485ad0928e0df8c369e969 [0,0,1,0,0,1|2,0,0]=4 285 B20R2.290374 C=Cc1ccccc1OC(C(=O)N)c2ccccc2 7306ef2bee37de2784870d5ac60e6dce [0,0,1,0,0,1|1,0,0]=3 286 B20R2.290374 C=Cc1ccccc1OC(C(=O)O)c2ccccc2 02ff07cd9f2a7997f46c828075ae86c2 [0,0,1,0,0,1|2,0,0]=4 287 B20R2.290374 C=Cc1cccnc1NC(C(=O)N)c2ccccc2 73f988692da35b9ed0899f0117b94710 [0,0,1,0,0,1|2,0,0]=4 288 B20R2.290374 C=Cc1cccnc1N[C@@H](C(=O)N)c2ccccc2 87b42e3fbb683d668939557a2c41ed2b [0,0,1,0,0,1|2,0,0]=4 289 B20R2.290374 C=Cc1cccnc1N[C@H](C(=O)N)c2ccccc2 5c728c7591d8dc4feb385c783ad09930 [0,0,1,0,0,1|2,0,0]=4 290 B20R2.290374 C=Cc1ncccc1NC(C(=O)N)c2ccccc2 209cde147e87a146f4ce46b3951e6c66 [0,0,1,0,0,1|2,0,0]=4 291 B20R2.290374 C=Cc1ncccc1N[C@@H](C(=O)N)c2ccccc2 e0d507e15a9e8666d55f4f7e7a18f87f [0,0,1,0,0,1|2,0,0]=4 292 B20R2.290374 C=Cc1ncccc1N[C@H](C(=O)N)c2ccccc2 2e17f37ed004d94b9c7a15b06c054566 [0,0,1,0,0,1|2,0,0]=4 293 B20R2.290374 NC(=O)C(Nc1ccccc1C=O)c2ccccc2 316eff60ec045119e9cfcff785fa2211 [0,0,1,0,0,1|2,0,0]=4 294 B20R2.290374 NC(=O)C(Oc1ccccc1C=O)c2ccccc2 f9c780feae3cf4d79daab9b6b40e3505 [0,0,1,0,0,1|2,0,0]=4 295 B20R3.463001 CCN1Cc2ccccc2/C=C\c3c1cccc3 319953b523e48e3dacd55ea45901410d [1,0,0,0,0,1|1,0,1]=4 296 B20R3.463001 CCN1Cc2ccccc2C=Cc3c1cccc3 e140113a31fbdb916c09680baf081d30 [1,0,0,0,0,1|1,0,1]=4 297 B20R3.463001 O=CN1Cc2ccccc2/C=C\c3c1cccc3 0f26d33ffc2d83e32eacaa73bdfa664b [1,0,0,0,0,1|0,0,0]=2 298 B20R3.463001 O=CN1Cc2ccccc2C#Cc3c1cccc3 93d607cc2f4cdcf3e4c63fa568aec7ed [1,0,0,0,0,1|0,0,2]=4 299 B20R3.463001 O=CN1Cc2ccccc2C=Cc3c1cccc3 54cadfbe4bf6c64e011ec0f4fbb59cbd [1,0,0,0,0,1|0,0,0]=2 300 B20R3.463001 O=CN1Cc2ccccc2CCc3c1cccc3 143f2560df3da86a7ec244d98f2b1635 [1,0,0,0,0,1|0,0,2]=4 301 B20R3.463001 OCN1Cc2ccccc2/C=C\c3c1cccc3 3647741d59bd646cc83a57e7e6338694 [1,0,0,0,0,1|0,0,2]=4 302 B20R3.463001 OCN1Cc2ccccc2C=Cc3c1cccc3 275ce74004c7cfe4d17128c1fa920db6 [1,0,0,0,0,1|0,0,2]=4 303 B20R3.5148346 CC(=O)Nc1c2ccccc2cc3c1cccc3 18f7aef96317da4d310633bb9c6f9210 [0,0,0,0,1,1|2,0,0]=4 304 B20R3.5148346 NC(=O)CN1c2ccccc2Cc3c1cccc3 5d40cc2c90c0389b5bfe860a516aed12 [0,0,0,0,1,1|0,0,1]=3 305 B20R3.5148346 NC(=O)CN1c2ccccc2Oc3c1cccc3 476d5a71a0c3600b8a79f20a9d9ee22c [0,0,0,0,1,1|1,0,0]=3 306 B20R3.5148346 NC(=O)CN1c2ccccc2Oc3c1ccnc3 0b842e76f6090ac85904ea01969a6b68 [0,0,0,0,1,1|2,0,0]=4 307 B20R3.5148346 NC(=O)CN1c2ccccc2Sc3c1cccc3 77db5200e1bee49695d1fe41f2cd0e0e [0,0,0,0,1,1|1,0,0]=3 308 B20R3.5148346 NC(=O)CN1c2ccccc2Sc3c1nccc3 c148b46966e2796ca9aa699b88436aaa [0,0,0,0,1,1|2,0,0]=4 309 B22R3.12290137 C=C(Br)CN1Cc2ccccc2/C=C\c3c1cccc3 b98fab3826dcff2b626ffc69c0c7dc4c [0,0,0,0,0,2|2,0,0]=4 310 B22R3.12290137 C=C(Br)CN1Cc2ccccc2C=Cc3c1cccc3 8c9e076f3d5bb4ced8b62843552cab78 [0,0,0,0,0,2|2,0,0]=4 311 B22R3.12290137 C=C(C)CN1Cc2ccccc2/C=C\c3c1cccc3 aa871a1a6138bd419cf2813c3ee84106 [0,0,0,0,0,2|2,0,0]=4 312 B22R3.12290137 C=C(C)CN1Cc2ccccc2C=Cc3c1cccc3 ce4283ac2ee7256c5c1d1929665f6a26 [0,0,0,0,0,2|2,0,0]=4 313 B22R3.12290137 C=C(Cl)CN1Cc2ccccc2/C=C\c3c1cccc3 6cef1036155e28dbc5393935fea27289 [0,0,0,0,0,2|2,0,0]=4 314 B22R3.12290137 C=C(Cl)CN1Cc2ccccc2C=Cc3c1cccc3 7020e5e7d0f5cb382a6d669c4a4999f0 [0,0,0,0,0,2|2,0,0]=4 315 B22R3.12290137 C=C(F)CN1Cc2ccccc2/C=C\c3c1cccc3 6a49d69d58697262eb7c47ef74fddc21 [0,0,0,0,0,2|2,0,0]=4 316 B22R3.12290137 C=C(F)CN1Cc2ccccc2C=Cc3c1cccc3 d3be07f23f47074b3249a940e390261f [0,0,0,0,0,2|2,0,0]=4 317 B22R3.12290137 NC(=O)CN1Cc2ccccc2/C=C\c3c1cccc3 de3f59b64a876c6c9f9a32fb29bf9df3 [0,0,0,0,0,2|0,0,0]=2 318 B22R3.12290137 NC(=O)CN1Cc2ccccc2C#Cc3c1cccc3 7c05a0387939a34059d2f1bd7c1ea79a [0,0,0,0,0,2|0,0,2]=4 319 B22R3.12290137 NC(=O)CN1Cc2ccccc2C=Cc3c1cccc3 903e856d42a6f715e5dc022c27f78a0d [0,0,0,0,0,2|0,0,0]=2 320 B22R3.12290137 NC(=O)CN1Cc2ccccc2CCc3c1cccc3 397c39f6de174a87c2e70281d4f6ddea [0,0,0,0,0,2|0,0,2]=4 321 B22R3.12290137 O=C(O)CN1Cc2ccccc2/C=C\c3c1cccc3 f3402bac214908ce9b10ee23975e63c5 [0,0,0,0,0,2|1,0,0]=3 322 B22R3.12290137 O=C(O)CN1Cc2ccccc2C=Cc3c1cccc3 1775dcabab5388914f019f8aed012654 [0,0,0,0,0,2|1,0,0]=3 323 B22R3.12290137 O=[N+]([O-])CN1Cc2ccccc2/C=C\c3c1cccc3 4f5d711ba336aed2f12a0f3b0e8188e7 [0,0,0,0,0,2|2,0,0]=4 324 B22R3.12290137 O=[N+]([O-])CN1Cc2ccccc2C=Cc3c1cccc3 b3bd195444eced1a07cecd93d4580b78 [0,0,0,0,0,2|2,0,0]=4 325 B22R3.12307660 C/C(=C/CN1c2ccccc2C=Cc3c1cccc3)/I bfbc30f17e973e018b345c27e94bd2b4 [0,0,0,0,0,2|2,0,0]=4 326 B22R3.12307660 C/C(=C\CN1c2ccccc2C=Cc3c1cccc3)/Cl f370ea13e0484efb27b5297c1933d0a8 [0,0,0,0,0,2|2,0,0]=4 327 B22R3.12307660 C=C(C)CCN1c2ccccc2C=Cc3c1cccc3 17a6124af71ef2e9ce5db7eb2a17a390 [0,0,0,0,0,2|2,0,0]=4 328 B22R3.12307660 CC(=CCN1c2ccccc2C=Cc3c1cccc3)C 4bbcc5435d3dfc4c31bc64c311cbba10 [0,0,0,0,0,2|2,0,0]=4 329 B22R3.12307660 CC(=CCN1c2ccccc2C=Cc3c1cccc3)Cl 0ded99c28338f34ac9a8a33a5d504fa3 [0,0,0,0,0,2|2,0,0]=4 330 B22R3.12307660 CC(=CCN1c2ccccc2C=Cc3c1cccc3)I aacab389dd0722441cb750295d14a6f9 [0,0,0,0,0,2|2,0,0]=4 331 B22R3.12307660 CC(=O)CCN1c2ccccc2C=Cc3c1cccc3 19f16cac85dfe715ba35c70a1b140bd5 [0,0,0,0,0,2|1,0,0]=3 332 B22R3.12307660 CC(=O)CNC1c2ccccc2C=Cc3c1cccc3 df014c021d24c5144e86573cee00ea95 [0,0,0,0,0,2|2,0,0]=4 333 B22R3.12307660 CC(=O)OCN1c2ccccc2C=Cc3c1cccc3 9ec84757845ef52b4cb456168783b54b [0,0,0,0,0,2|1,0,0]=3 334 B22R3.12307660 CS(=O)CCN1c2ccccc2C=Cc3c1cccc3 daca2a49081363eb8a4370a1f1b21a8e [0,0,0,0,0,2|2,0,0]=4 335 B22R3.12307660 ClC(=CCN1c2ccccc2C=Cc3c1cccc3)Cl 005d1c47b2701995611a518ef2884a88 [0,0,0,0,0,2|2,0,0]=4 336 B22R3.12307660 NC(=O)CCN1c2ccccc2C=Cc3c1cccc3 a85acc3ed281aa3f8466818e1fb549aa [0,0,0,0,0,2|0,0,0]=2 337 B22R3.12307660 NC(=O)CCN1c2ccccc2CCc3c1cccc3 bbc22b3e0f80e71cf32be3274a1d97aa [0,0,0,0,0,2|0,0,2]=4 338 B22R3.12307660 NC(=O)CCN1c2ccccc2COc3c1cccc3 af2e3a426efedc516fe802ff3eb0c417 [0,0,0,0,0,2|1,0,1]=4 339 B22R3.12307660 NC(=O)CNC1c2ccccc2C=Cc3c1cccc3 a5ed284ef7d0d21a80badcff488f636a [0,0,0,0,0,2|1,0,0]=3 340 B22R3.12307660 NC(=O)COC1c2ccccc2C=Cc3c1cccc3 9302e38319121314f971e6e76173c700 [0,0,0,0,0,2|1,0,0]=3 341 B22R3.12307660 O=C(O)CNC1c2ccccc2C=Cc3c1cccc3 d8826a530539fb18258085d4905693c4 [0,0,0,0,0,2|2,0,0]=4 342 B22R3.12307660 O=C(O)COC1c2ccccc2C=Cc3c1cccc3 cf4947b75fadfd5955cad26944a5ac21 [0,0,0,0,0,2|2,0,0]=4