urdof7 commited on
Commit
4886a12
·
verified ·
1 Parent(s): 4cf7008

Added 280 molecules from epoch 16737 for P31645

Browse files
Files changed (1) hide show
  1. P31645_molecules.csv +280 -0
P31645_molecules.csv CHANGED
@@ -39757,3 +39757,283 @@ rxn:2:80951:108624,CC1CCc2nn(CCN(C)C)c(NC3CCCC(OC4CC4)C3)c21,FVZSHZHDEVDWHM-UHFF
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  rxn:2:90234:112775,Cc1nn(CCN(C)C)c(NC2CC3CCCCCC3C2)c1C1(C)CC1,XOBSCGDJZNYPTC-UHFFFAOYSA-N
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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39924
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39925
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39926
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39927
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39928
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39929
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39930
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39931
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39932
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39933
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39934
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39935
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39936
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39937
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39938
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39939
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39940
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39941
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39942
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39943
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39944
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39945
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39946
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39947
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39948
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39949
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39950
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39951
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39952
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39953
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39954
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39955
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39956
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39957
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39958
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39959
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39960
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39961
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39962
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39963
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39964
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39965
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39966
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39967
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39968
+ rxn:2:100302:113704,CC1CN(C2CCCCC2)CCC1NCC#CCN(C)C,ZPBTZVOAGUSJAU-UHFFFAOYSA-N
39969
+ rxn:2:107571:118786,Cc1nn(CCN(C)C)cc1CNC1CCC(OC2CCCCC2)CC1,LUBABPDLFFAYAE-UHFFFAOYSA-N
39970
+ rxn:2:109191:131521,CC1CN(CCNC2CCCN3CCCC3C2)CC(C)N1C,XJRYLVQNKZANIQ-UHFFFAOYSA-N
39971
+ rxn:2:113704:94627,CN(C)CC#CCNCC1CCCN1C1CCCCC1,UZFIHYIRFJBASI-UHFFFAOYSA-N
39972
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39973
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39974
+ rxn:2:117421:129604,CN(C)CC1CCCN(CCNC2CCCCC2(C)C)C1,BVSGYCPBXYHRON-UHFFFAOYSA-N
39975
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39976
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39977
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39978
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39979
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39980
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39981
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39982
+ rxn:2:131521:67804,CC1CN(CCNC2CCN3CCCC3C2)CC(C)N1C,ZUSIABUMFIWXLH-UHFFFAOYSA-N
39983
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39984
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39985
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39986
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39987
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39988
+ rxn:2:67358:72493,CC(CCC1CCC1)N[C@H](CN(C)C)C1CCCCC1,GIXQGBVLURPAHX-KPMSDPLLSA-N
39989
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39990
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39991
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39992
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39993
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39994
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39995
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39996
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39997
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39998
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39999
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40000
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40001
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40002
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40003
+ rxn:2:76638:100518,CN(C)CC#CCCNC1CCCCC1N1CCCC1,KFVOQKNCJCRSQS-UHFFFAOYSA-N
40004
+ rxn:2:76638:104810,CC1CN(CC2CC2)CCC1NCCC#CCN(C)C,QPOATMLNURQHJW-UHFFFAOYSA-N
40005
+ rxn:2:76638:108002,CN(C)CC#CCCNCC1CCCCN1C1CCC1,VCNGKKVGYGRGNL-UHFFFAOYSA-N
40006
+ rxn:2:76638:109037,CN(C)CC#CCCNCC1CCCN1C1CCCC1,XLQVOMVDTLXBNU-UHFFFAOYSA-N
40007
+ rxn:2:76638:112291,CC1CCCC(N2CCC(NCCC#CCN(C)C)CC2)C1,HDAUKBJPHZOKNV-UHFFFAOYSA-N
40008
+ rxn:2:76638:118251,CC1CN(CC2CCCCC2)CCC1NCCC#CCN(C)C,WSZVZPGVENVUGU-UHFFFAOYSA-N
40009
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40010
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40011
+ rxn:2:76638:132617,CN(C)CC#CCCNCC1CCCCN1CC1CC1,KDXACTMZIJODNH-UHFFFAOYSA-N
40012
+ rxn:2:76638:69316,CN(C)CC#CCCNC1CCN(C2CCCC2)CC1,FETJVERKBFCAOK-UHFFFAOYSA-N
40013
+ rxn:2:76638:87494,CN(C)CC#CCCNC1CCC(N2CCCC2)CC1,AFSUJCRYXHYWFP-UHFFFAOYSA-N
40014
+ rxn:2:76638:95574,CN(C)CC#CCCNC1CCCC1N1CCCCC1,SVBWJWYUUPUHKL-UHFFFAOYSA-N
40015
+ rxn:2:76638:96042,CN(C)CC#CCCNC1CCCN(C2CCCC2)C1,BKZFEACBLLWVEO-UHFFFAOYSA-N
40016
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40017
+ rxn:2:76638:99124,CN(C)CC#CCCNC1CCC2(CCCCN2C)CC1,UVJNCVHMKYNNEO-UHFFFAOYSA-N
40018
+ rxn:2:78163:132988,CN1CCN(CC#CCCNC2CCCC(N(C)C)CC2)CC1,MFMWBBHZSFJCBA-UHFFFAOYSA-N
40019
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40020
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40021
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40022
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40023
+ rxn:2:80427:85590,Cc1nn(CCN(C)C)c(NC2CC(CN3CCCC3)C2)c1C1CCC1,LTRHTBSNNNKZNC-UHFFFAOYSA-N
40024
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40025
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40026
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40027
+ rxn:2:85590:80427,Cc1nn(CCN(C)C)c(NC2CC(CN3CCCC3)C2)c1C1CCC1,LTRHTBSNNNKZNC-UHFFFAOYSA-N
40028
+ rxn:2:85671:132682,CN(C)C1CCN(CC(C)(C)NC2CCN(C)C23CCCC3)CC1,ONZLBBQTTQNQRN-UHFFFAOYSA-N
40029
+ rxn:2:85671:80427,Cc1nn(CCN(C)C)c(NC2CCN(C)C23CCCC3)c1C1CCC1,KQHBFYOFPIBQGQ-UHFFFAOYSA-N
40030
+ rxn:2:86382:115450,Cc1cc(C)c(CNC2CCCCC2N(C)C)c(OC2CCN(C)CC2)n1,CYABXFXLYZQQEK-UHFFFAOYSA-N
40031
+ rxn:2:86382:118272,Cc1ccc(CNC2CCCCC2N(C)C)c(OC2CCN(C)CC2)n1,NOODERDYDXDUNP-UHFFFAOYSA-N
40032
+ rxn:2:86837:133032,COc1cnc(CNC2CCC(CN(C)CC3CCN(C)CC3)CC2)o1,VLNFKVPVRFWPOT-UHFFFAOYSA-N
40033
+ rxn:2:91227:106936,C[Si](C)(C)C1CCCC(NCc2occc2COC2CCCCCC2)C1,DCUBHVVJHQGNJK-UHFFFAOYSA-N
40034
+ rxn:2:91227:137171,C[Si](C)(C)C1CCCC(NCc2cccc(CSC3CCCCC3)c2)C1,UKYIHEXIFDXFND-UHFFFAOYSA-N
40035
+ rxn:2:91227:137963,C[Si](C)(C)C1CCCC(NCc2cccc(COC3CCCCC3)c2)C1,BWFGFWOLZNGNIJ-UHFFFAOYSA-N
40036
+ rxn:2:94627:113704,CN(C)CC#CCNCC1CCCN1C1CCCCC1,UZFIHYIRFJBASI-UHFFFAOYSA-N
40037
+ rxn:2:95162:140601,CCCC(CCC1CCCCC1)N[C@H]1CC[C@@H](N(C)C)C1,GYLSSHMLPOIRSC-JLMCIHFGSA-N
40038
+ rxn:2:95443:123882,CN(C)CCC1CCC(NCC#CCN2CCC2)CC1,XGINXWLQQSOUIP-UHFFFAOYSA-N
40039
+ rxn:2:99124:140418,Cc1nn(CCN(C)C)c(NC2CCC3(CCCCN3C)CC2)c1C1CC1,KBXPUCHWFZPQLP-UHFFFAOYSA-N