Added 139 molecules from epoch 15624 for P23975
Browse files- P23975_molecules.csv +139 -176
P23975_molecules.csv
CHANGED
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@@ -21606,179 +21606,142 @@ F98A4FBCF185C907_23B38F8D7E1440CE_6026_UN,CC1=C(C=C(C(=C1)[S](=O)(=O)NCC2=C(C)C=
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F9B16DD6A56F093C_9A8517BB17F8700C_6035_UN,CC(C)C2=CN=C(COC1=C(C=C(C)C=C1C)[N](=O)=O)O2,QYSKNONXZBJERU-UHFFFAOYSA-N
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| 21607 |
FA6D763C9978C7A5_26B1D5AAAA22B2D8_6026_UN,O=[N](=O)C1=C(C=CC(=C1)[S](=O)(=O)N[S](=O)(=O)OC2=CC(=CC=C2)C#N)Br,TWHDLYYCHBSJCD-UHFFFAOYSA-N
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| 21608 |
FE5442E048627409_3D75F6EADE7FD450_7022_UN,C1(=CC(=C(C=C1)F)[N](=O)=O)OCC2=N[N](C(C)C)C(=C2)C,REDRFZBKLJHTQT-UHFFFAOYSA-N
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| 21748 |
-
CC0D8EA639C88650_9566950050EAE527_6041_DP,C[N]1C(=CN=C1C2CCCCN2)NC[C@@]3(CCCN3)C,UAFXTNJJOHSZFM-CVRLYYSRSA-N
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| 21749 |
-
CC9F882AD66CA8FA_47C0E74BE1D5A32E_7015_UN,CCC3=C(N[S](=O)(=O)CC1=CSC=C1)C(=O)N(C2=CC=CC=C2)N3C,BQRDEADDKGSHEC-UHFFFAOYSA-N
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| 21750 |
-
CEA2444639F21928_865429BE334624BE_7022_UN,CC(C)CC1=CC(=C(C=C1)OC3C2CCOC2C34CCC4)F,NQWWFBRQPJGRHT-UHFFFAOYSA-N
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| 21751 |
-
CFBC08B93F2BD2B3_2F3081D3F9E7B673_7009_DP,NC1=CC(=CC=C1)[S](=O)(=O)NC(C(C)N3C(=C)C2=C(C=CC=C2)C3=O)=O,NPIRUSUUYIDJRD-UHFFFAOYSA-N
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| 21752 |
-
CFF850652DB07519_7E5A67160C61062F_7022_UN,CC(C)CC1=CC(=C(C=C1)OC3C2CCOC2C34CCCCC4)F,DBORLVBSPXATCK-UHFFFAOYSA-N
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| 21753 |
-
D0667D47C30C147D_B77B070B592BA01A_7019_UN,C(C2CC1OC1C2)=CC(C)=CC3=C(C=CC=C3)OC(F)F,HJAAKSOCXIODBJ-UHFFFAOYSA-N
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| 21754 |
-
D153102860B975F8_E90DFF38D315A4A6_6038_UN,N(CC1OCC[S](C1)(=O)=O)C(=O)CC2=C[NH]C3=C2C=CC=C3,TXSBWQZZWKGDHK-UHFFFAOYSA-N
|
| 21755 |
-
D249957AA8B73198_A416E3977819AFBB_6034_UN,CC1=CN(C(=O)N1C2=CC=CC=C2)CC3C(CNCC3)(F)F,WMFCXPAXQVZUBS-UHFFFAOYSA-N
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| 21756 |
-
D3E13780095BD12E_0AFE569F1F3864F5_6034_UN,CC1=C(C(=C(C(N1CC2CSCC(N2)C3=CC=CC=C3)=O)C)Br)C,LPBMTCMXEKXODG-UHFFFAOYSA-N
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| 21757 |
-
D5E17494FB62A111_0B4E8973A5A8D455_6041_DP,OC(=O)[C@@H]1CC[C@H](N1)C2=CC=C(C=C2)NCC(C3CCNCC3)F,UAONCTJMFIBPDJ-BSOSBYQFSA-N
|
| 21758 |
-
D7477F57FA309EFE_53D4075C726BCEB2_6041_UN,O=[N](=O)C1=C(C=CC=C1)NC3=C(C=C2OCCOC2=C3)S,FGRSSKJKYTVKJL-UHFFFAOYSA-N
|
| 21759 |
-
D7477F57FA309EFE_658AB664BC21CE78_6041_UN,O=[N](=O)C1=C(C=CC=C1)NC3=C(C=C2OCCOC2=C3)S,FGRSSKJKYTVKJL-UHFFFAOYSA-N
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| 21760 |
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D7477F57FA309EFE_99C3CF698C91F337_6041_UN,O=[N](=O)C1=C(C=CC=C1)NC3=C(C=C2OCCOC2=C3)S,FGRSSKJKYTVKJL-UHFFFAOYSA-N
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| 21761 |
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DE1471DF2C1D49E9_096E8BAC96A8C526_7022_UN,CC(C)CC1=CC(=C(C=C1)OC3C2CCOC2C34CCCC4)F,JKFPIRQADWLTHK-UHFFFAOYSA-N
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DE224F90D065D283_1739B44D5298F31C_6031_UN,O(C(=O)C1(CC1)C2=CCNCC2)CC3=CC=C(C=C3)F,HYXBIDFTOQNYPB-UHFFFAOYSA-N
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| 21763 |
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E079E91C258BEE7B_5200BB86B43E6629_6041_UN,O=[N](=O)C2=C1[NH]N=CC1=C(C=C2)NCC3OCOCC3,FHLMEHKVOZJEGG-UHFFFAOYSA-N
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| 21764 |
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E1C58F3F96198A2B_8EF7E56B57202ED6_6038_DP,O(C(C=C)C1=C(C=CC=C1)F)C([C@H]2CO[C@H]3CNC[C@@H]23)=O,HVRJIKZMMILAEG-AHWDPPSRSA-N
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| 21765 |
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E22C69F73F98FC02_B1C137B84B8C1480_6029_UN,CN1C4=C(OC[C@@H](C1=O)N[S](C3=CC2=C(C=CC=C2)S3)(=O)=O)C=CC=C4,KWWFBBZBONRJLC-ZDUSSCGKSA-N
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| 21766 |
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E301A61D55F7B52F_31388ED5A5007559_6041_UN,CC(C)C1=C(C=C(C=C1)NC[C@@H]2CC[C@@H](O2)C3CC3)F,ZWMKTRPICUPWTG-WMLDXEAASA-N
|
| 21767 |
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E44F0F180CEC4FBC_D72C061AD16CBF18_6026_UN,CC1=C(C(=CC(=C1)[N](=O)=O)C)[S](=O)(=O)N[S](=O)(=O)OC2=CC=CC=C2,YBTCVNGZIDAYOQ-UHFFFAOYSA-N
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| 21768 |
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E62E3609BAF97A6F_DBA4A329A43CE7ED_6038_DP,N3CC(=C(F)COC(=O)[C@@H]2C[C@H](CC1CCC1)CN2)C3,YMKQPINCSZWIBU-FZMZJTMJSA-N
|
| 21769 |
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E7F83178C498775D_D689C2CC96B3F95A_6038_DP,C[C@@H](OC(=O)CC1COCC2=C1C=CC=C2)C3CNC3,ALKRRWBVGORDRS-JTDNENJMSA-N
|
| 21770 |
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EB7834CDC703AE7F_479B3CC1A8D4663D_6039_UN,C[C@@H](OCC2CC1OCCC1O2)C3=C(C=CC(=C3)F)C,WMVNXTKYPLYWDN-SOHQLFRFSA-N
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| 21771 |
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ED97C3A802DC2828_981235C117EBE73D_7022_UN,CC(C)CC1=CC(=C(C=C1)OC3CCC2COCCC2C3)F,LGVZMCQJOOGZGA-UHFFFAOYSA-N
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| 21772 |
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F21FA400B4A7ED2C_E37FD2C416AF92B9_6041_DP,C[N]1C(=CN=C1C2CCCCN2)NCC3(CCCN3)C,UAFXTNJJOHSZFM-UHFFFAOYSA-N
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| 21773 |
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F28D84B6A327F850_B7FC5A5E064CF4CA_6034_UN,CC1=C(C=C(C(N1CC2CSCC(N2)C3=CC=CC=C3)=O)Br)N,SVAJITSOBARUBJ-UHFFFAOYSA-N
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| 21774 |
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F4731C3257093761_F03AEE49C958A58D_6029_UN,CC2N(C1=C(C=CC=C1)C2C)[S](C4=CC=C(OCC3=CC=C([N](=O)=O)C=C3)C=C4)(=O)=O,NQAXCTCHXOXOBN-UHFFFAOYSA-N
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| 21775 |
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F4C36992E86D5B09_C01A4F802A829701_6041_UN,O=[N](=O)C2=C(C=C1OCOC1=C2)NC4=C(C=C3OCCOC3=C4)S,UNRWPFDUXICATC-UHFFFAOYSA-N
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| 21776 |
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F59A7CF5BDA64741_BE4A2F12742C0439_6039_UN,C[C@H](OCC2CC1OCCC1O2)C3=C(C=CC(=C3)F)C,WMVNXTKYPLYWDN-VHBBEVCXSA-N
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| 21777 |
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F78ADE7815DC0AA6_C1A9607A425A8622_6038_DP,N3CCOCC(CNC(=O)C(=O)C1=C[NH]C2=C1C=CC(=C2)F)C3,VNVIZYODESTFLT-UHFFFAOYSA-N
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| 21778 |
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F8F135674EB1DC92_FF00BF27D7577696_6041_DP,C[Si](C)(C)C1=C(C=CC=C1)NC[C@@H]2CN[C@@H]3CCCC[C@H]23,YHPBQDCTWPBCEO-ARFHVFGLSA-N
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| 21779 |
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F9EF4BFC6B3F73B8_749966344357ADD7_7009_UN,N([S](=O)(=O)C1(CC=C)CC1)C(C[N]2C3=C(C=C2C)C=CC=C3)=O,AJCOOJGOWOASHX-UHFFFAOYSA-N
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| 21780 |
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FAE5E490C57BB201_517034D93506DF2A_7009_UN,N([S](=O)(=O)C2(CC1=CC=CC=C1)CC2)C(=O)CC(C3=CC=CS3)[N]4C=CC=C4,RRNXYCAJQQCQSP-UHFFFAOYSA-N
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| 21781 |
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FC982C9D5929C4B9_A4714582A77A22BD_6004_UN,O=[N](=O)C1=C(C=CC(=C1)C3=C2OCCCC2=CC=C3)S,HQICVRNZNLFLII-UHFFFAOYSA-N
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| 21782 |
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FE153134155E56D3_C8981927FCBEA6F4_6041_UN,CC1=C(C2=C([NH]1)C=CC=C2NCC(C)C3CCCC3)C,BKNRDAVEJNWZKW-UHFFFAOYSA-N
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| 21783 |
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FF13E5ECA31AA0F0_077264FF88A18816_6041_UN,C[N]1N=C(C=C1NC(CC)C2CC2(C)C)C3CCCC3,ZGIPOJIOIBXEJI-UHFFFAOYSA-N
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| 21784 |
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FF42625CEE5F0B77_1F401AC860075474_6038_UN,N(CC1=CC(=CC=C1)N2CC=CC2)C(=O)C3COC4=C3C=C(C=C4)[N](=O)=O,UDKGUWLBZYHFHS-UHFFFAOYSA-N
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| 21606 |
F9B16DD6A56F093C_9A8517BB17F8700C_6035_UN,CC(C)C2=CN=C(COC1=C(C=C(C)C=C1C)[N](=O)=O)O2,QYSKNONXZBJERU-UHFFFAOYSA-N
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| 21607 |
FA6D763C9978C7A5_26B1D5AAAA22B2D8_6026_UN,O=[N](=O)C1=C(C=CC(=C1)[S](=O)(=O)N[S](=O)(=O)OC2=CC(=CC=C2)C#N)Br,TWHDLYYCHBSJCD-UHFFFAOYSA-N
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| 21608 |
FE5442E048627409_3D75F6EADE7FD450_7022_UN,C1(=CC(=C(C=C1)F)[N](=O)=O)OCC2=N[N](C(C)C)C(=C2)C,REDRFZBKLJHTQT-UHFFFAOYSA-N
|
| 21609 |
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036C30B10AD74DED_1605015A3DF9D88A_6004_UN,NC1=C(N=C(C=C1)C2=CC3=C(C=C2)OC4=C3C=CC=C4)[N](=O)=O,REMSXXYKKIYHRY-UHFFFAOYSA-N
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| 21610 |
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047AC2C7C81748D6_B138005F6A4AB242_6029_UN,N(C1=C(C=C(C=C1)I)O)[S](C2=C(C=CC(=C2)F)N=[N]#N)(=O)=O,IUACKWGFPKYCGH-UHFFFAOYSA-N
|
| 21611 |
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| 21612 |
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080953E652FF1AC4_70534856CABA164E_6026_UN,[S](=O)(=O)(C1=CC=CO1)NCCC2=CC3=C(C=C2)COCC3,VTSMFUPLJTWFDZ-UHFFFAOYSA-N
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| 21613 |
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| 21614 |
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0EE2D9C19CB4F8E3_AAE146D3A58F1C7A_6031_DP,O(C(=O)[C@@H]1C[C@H]1C2=C(C=CC=C2)Cl)CC3CNCCNC3,MUYHBEFGPFNCKP-UONOGXRCSA-N
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| 21615 |
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1044C9594680939D_A6A2EFF3B360E1C6_6035_UN,CN(C)[C@@H]1COC[C@H]1OC2=C(C=C(C=C2)CN3CCNCC3)Cl,LDAMHNQRGVBGNG-NVXWUHKLSA-N
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|
| 21617 |
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1067E236AF93E5D8_8CC2835845C1D642_6026_UN,ClC1=CC2=C(C=C1)C(=C[NH]2)[S](=O)(=O)N3C4CCOCC34,UHMZQRDWXJNKRB-UHFFFAOYSA-N
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| 21618 |
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156321088B1C150A_B1FA3C23097E8F2A_6034_DP,CN4CCC1=C(C3=C([N]1CC2CNC2)C=CC(=C3)Cl)C4,BLTOGOVAPZZPIY-UHFFFAOYSA-N
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| 21625 |
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1C2316923C0F3101_DB3700D267D2F742_6003_UN,O(C2=C1C=CC=NC1=CC=C2)C4=CC3=C(OCCO3)C=C4[N](=O)=O,RDWXRPBBFRCAGU-UHFFFAOYSA-N
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| 21626 |
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1C2C337BB918DD39_9001B157A7DE615D_6039_UN,O(CC1C2CCOCC12)CC(C3=CC=CC(=C3)OC)F,HFWPSUIRVLJGAQ-UHFFFAOYSA-N
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| 21627 |
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20B75497770C1074_ECEB6DE5A12FAC79_7005_UN,N3=C(C1=CC=C(O1)[N](=O)=O)[NH]C4=CC2=C(C=CC=C2)C=C34,RDWTZLCANNTUNU-UHFFFAOYSA-N
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| 21628 |
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23FEF0FEC22A983B_6629445DAEA7EA30_6041_UN,FC2=C(C=C1NC(NC1=C2)=O)NC4=C(C=C3OCOC3=C4)[N](=O)=O,SXGFMOALOHSKGH-UHFFFAOYSA-N
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| 21629 |
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| 21631 |
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