smiles1 cid1 smiles2 cid2
C(Nc1cc(OC)ccc1OC)(c1cc(I)ccc1)=O ChemBridge_DiverSet_20k N1(C(SC(\C1=O)=C\c1cc(OC)c(cc1)OCCCCC)=S)CC(=O)OC Sample_2
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