Added 1 molecules from epoch 18727 to P23975_molecules_TEST.csv
Browse files
P23975_molecules_TEST.csv
CHANGED
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@@ -33,3 +33,4 @@ rxn:5:194145:226597:228198,COC(=O)c1cc2c(-c3cc(F)c(OC(C)C)c(F)c3)cc(-c3cnc(C(C)C
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| 33 |
rxn:5:197522:229073:226749,COc1cnccc1-c1ccc2nc(-c3c(OC)cccc3C(F)(F)F)c(C(C)=O)cc2c1,CEUKZSFPXSKTQE-UHFFFAOYSA-N
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| 34 |
rxn:4:184873:226793,CCN(C)C(=O)c1cc(OC)c(OC)cc1-c1cnn(-c2ccc(F)cn2)c1,FWKWMYMTEZQFND-UHFFFAOYSA-N
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| 35 |
rxn:4:222296:224654,CC(C)(C)[Si](C)(C)Oc1cc(-c2cnc(OCC3CCCN(c4ccc5nncn5n4)C3)nc2)ccc1F,FAHRDNBKTNNVDL-UHFFFAOYSA-N
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| 33 |
rxn:5:197522:229073:226749,COc1cnccc1-c1ccc2nc(-c3c(OC)cccc3C(F)(F)F)c(C(C)=O)cc2c1,CEUKZSFPXSKTQE-UHFFFAOYSA-N
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| 34 |
rxn:4:184873:226793,CCN(C)C(=O)c1cc(OC)c(OC)cc1-c1cnn(-c2ccc(F)cn2)c1,FWKWMYMTEZQFND-UHFFFAOYSA-N
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| 35 |
rxn:4:222296:224654,CC(C)(C)[Si](C)(C)Oc1cc(-c2cnc(OCC3CCCN(c4ccc5nncn5n4)C3)nc2)ccc1F,FAHRDNBKTNNVDL-UHFFFAOYSA-N
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| 36 |
+
rxn:4:198987:228236,Cc1cccc2c(-c3ccnc(F)c3C3CC3)nccc12,AIINGINQKDWPMD-UHFFFAOYSA-N
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