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cosmic-amanita commited on
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9ea66e0
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1 Parent(s): 9790172

Added 1 molecules from epoch 18840 to P23975_molecules_TEST.csv

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  1. P23975_molecules_TEST.csv +1 -0
P23975_molecules_TEST.csv CHANGED
@@ -139,3 +139,4 @@ rxn:4:206901:225756,COC(=O)c1cc(-c2ccc(CN3CCCN(C)CC3)o2)c(C(C)C)cn1,IDOIJRVEZMVN
139
  rxn:5:181906:223270:228419,CSc1cc(F)c(-c2c(C)ccc(-c3ccc(F)cc3NC(C)=O)c2C2OCCO2)cc1F,PYPLPOUZBDDGNA-UHFFFAOYSA-N
140
  rxn:2:160686:131085,CC(C)COCCC(C)Nc1ccnn2c(-c3ccccc3)nnc12,VXLCASPNQMVFAO-UHFFFAOYSA-N
141
  rxn:2:138507:75485,Cc1ccc2ccccc2c1NC1CCCC1Cc1ccc2c(c1)OCO2,OWIZBMFSVDBAOC-UHFFFAOYSA-N
 
 
139
  rxn:5:181906:223270:228419,CSc1cc(F)c(-c2c(C)ccc(-c3ccc(F)cc3NC(C)=O)c2C2OCCO2)cc1F,PYPLPOUZBDDGNA-UHFFFAOYSA-N
140
  rxn:2:160686:131085,CC(C)COCCC(C)Nc1ccnn2c(-c3ccccc3)nnc12,VXLCASPNQMVFAO-UHFFFAOYSA-N
141
  rxn:2:138507:75485,Cc1ccc2ccccc2c1NC1CCCC1Cc1ccc2c(c1)OCO2,OWIZBMFSVDBAOC-UHFFFAOYSA-N
142
+ rxn:1:64517:19593,CC1=NN(c2c(Cl)cc(Cl)cc2Cl)C(=O)C1Cc1cn(CC2CC(=O)N(c3cc(Cl)ccc3OC(F)F)C2)nn1,XAJPSKKWULBYDF-UHFFFAOYSA-N