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O(C(=O)C1=C(OC=N1)C2=CC=CS2)CC4=CC3=CC=N[N]3C=C4 | C111AC908D0B0DD6_7C830424E7A3B58D_6031_UN | 23 | "DAC2E62A2A9F4109" | "A641E20ECD3CF484" | YOFRNRSQEVDVNC-UHFFFAOYSA-N | 00000000000000000000000000000000000010000000000000001000010000100100000000000000110100001100001110100100010001100000010011111110000000000100001010101010111111010111110 | 2.739331 | 5.474438 | 3.667345 | 5.958083 | 4.356352 |
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O(C(=O)C1=C(OC=N1)C2=CC=CS2)CC3CNCC(O3)C(F)(F)F | E2B09EE915658FE9_241D8369B7EDEA72_6031_UN | 24 | "DAC2E62A2A9F4109" | "FEDF65439D72AB7B" | KLQZHGPTMPGROK-UHFFFAOYSA-N | 00000000000000000000000000000000000010000010000000000000010000100100000010000000011100101110000111101000001101101000010011010110100010100110101010100011111111110111110 | 8.972541 | 7.488981 | 8.203666 | 7.383035 | 5.855323 |
O(C(=O)C1=C(OC=N1)C2=CC=CS2)CC(F)(F)C3CC3 | D9AA9E9B8DDE2F6E_2E9518EAAFC2C41E_6031_UN | 20 | "DAC2E62A2A9F4109" | "F457FEC0855D8517" | WQUIOJZCLHSHJT-UHFFFAOYSA-N | 00000000000000000000001000000000000010000010000000000000010000100100000000000000010100001100000110000000000101101000010011010110110000100100000010110010111111010110110 | 4.561174 | 6.150038 | 4.275598 | 6.190941 | 4.340007 |
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