Added 226 molecules from epoch 15635 for P23975
Browse files- P23975_molecules.csv +226 -0
P23975_molecules.csv
CHANGED
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@@ -22947,3 +22947,229 @@ FCC61F8254748CBF_B3CDC31F1C1BFD3E_6041_DP,CC(C)(C)CC1=CC=C(C=C1)NCCC2CSCCN2,GQOM
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| 22947 |
FF261191E7B28536_7471E8EDD36F8D08_6041_DP,N1C[C@H](CO1)[N]2C=C(C=N2)NC3=CC=CC4=C3C=CC(N4C)=O,JFQYNAPEZABFFV-GFCCVEGCSA-N
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| 22948 |
FF6BB8696227AF54_8C31F7DCE716789D_6038_DP,FC1=CC=C(C=C1)SC(C3(C2=CCNCC2)CCOCC3)=O,CAYFPHSVYAMRJW-UHFFFAOYSA-N
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| 22949 |
FF9A45130731025E_F51462158E1B2D27_6041_UN,CN1C(=O)NC(=O)C2=C1[NH]C(=N2)NCC4=C3OCCCOC3=CC=C4,GVXFFYUFLURXGT-UHFFFAOYSA-N
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| 22947 |
FF261191E7B28536_7471E8EDD36F8D08_6041_DP,N1C[C@H](CO1)[N]2C=C(C=N2)NC3=CC=CC4=C3C=CC(N4C)=O,JFQYNAPEZABFFV-GFCCVEGCSA-N
|
| 22948 |
FF6BB8696227AF54_8C31F7DCE716789D_6038_DP,FC1=CC=C(C=C1)SC(C3(C2=CCNCC2)CCOCC3)=O,CAYFPHSVYAMRJW-UHFFFAOYSA-N
|
| 22949 |
FF9A45130731025E_F51462158E1B2D27_6041_UN,CN1C(=O)NC(=O)C2=C1[NH]C(=N2)NCC4=C3OCCCOC3=CC=C4,GVXFFYUFLURXGT-UHFFFAOYSA-N
|
| 22950 |
+
0309215BA64E9547_788F787BA279D060_6035_UN,O(C2CCC1COCCC1C2)C3=CC(=C(C=C3I)I)C(C)(C)C,MCPHOUUQPPQQOW-UHFFFAOYSA-N
|
| 22951 |
+
0554252233ADB567_7A73B7450D509498_6035_UN,COCC3(COC1=C(C=C(C(C)(C)C)C=C1)I)CC2OC2C3,MVGKRWBYXGNPRB-UHFFFAOYSA-N
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| 22952 |
+
0677F9F4ECFF20C2_8B05DED3BEFF3D63_6038_DP,N(CCCCC(=N)N)C(CC1CNC2C1NCCC2)=O,GIABIYIDAGWFLJ-UHFFFAOYSA-N
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| 22953 |
+
07001DB88F31078C_858BDAD9945D91E2_6041_UN,O=[N](=O)C2=C1[NH]N=CC1=CC(=C2)NC3CN(CC3)C(=O)N,VRQYVMMSBGOUDY-UHFFFAOYSA-N
|
| 22954 |
+
0815FB6795BC0F29_E7C866E49495E0C0_7009_UN,CCCC(C)[S](=O)(=O)NC(C[N]1C=C(C)C2=C1C=CC=C2)=O,WTFJFJMYKOLBIY-UHFFFAOYSA-N
|
| 22955 |
+
099533C1316F7063_B4942B9283B1F3B4_6041_UN,O=[N](=O)C1=C(C=C(C(=C1)NCC2=NN=C([NH]2)C3COCC3)F)F,OMOIIPUCMNEFEZ-UHFFFAOYSA-N
|
| 22956 |
+
0B5885D622BABFB3_DC1104E4B74ED824_6039_UN,CC1=CC(=O)NC2=C1C=CC(=C2)OCCC[S](C)(=O)=O,FMINOFIXXFXUEL-UHFFFAOYSA-N
|
| 22957 |
+
0C462B7A5065F75C_CF66F3CA2739F552_6034_UN,BrC2=C1N(C3=C(C1=CC=C2)CSCC3)CC4(CN(C)C)CCC4,QITUNLQWHYOWDH-UHFFFAOYSA-N
|
| 22958 |
+
0D3D1B0A36A0EAAB_C8B2650A76C07E13_6029_UN,CC(=C)C[S](=O)(=O)N[S](C1=C[NH]C2=C1C=C(C)C=C2)(=O)=O,WYEZAIRURCVICT-UHFFFAOYSA-N
|
| 22959 |
+
0DDB543AC2120745_3B6CE9880B5C49A9_6041_UN,CN1CCN(CC1)C2=NC(=NS2)NC3(CC3)C4=CC5=C(C=C4)OCO5,QBQIATFSTMIZKP-UHFFFAOYSA-N
|
| 22960 |
+
133632DB7A72F456_E599CEB39880D81D_6034_UN,FC1=CC2=C(C=C1)C(=CN2CC(CC)(C)C=C)C3=CCNCC3,AGEZXOSVDWTFLL-UHFFFAOYSA-N
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| 22961 |
+
13E2863BDE83B424_23D4237DD48BBBE6_6031_UN,NC(CC1=CC=C[NH]1)C(=O)OCC2CC(=NO2)C3CC3,BTIKKFXGFVHLKB-UHFFFAOYSA-N
|
| 22962 |
+
13E2863BDE83B424_3E627761FC329BD2_6031_DP,NC(CC1=CC=C[NH]1)C(=O)OCC2CC(=NO2)C3CC3,BTIKKFXGFVHLKB-UHFFFAOYSA-N
|
| 22963 |
+
1436DF48EC9B5959_B2C6E69F89C554FD_6029_UN,CCN(C1=C(C=CC=C1)C)[S](=O)(=O)N[S](C2=CC(=C(C)C=C2)I)(=O)=O,DKGCMNQVCCVUDU-UHFFFAOYSA-N
|
| 22964 |
+
146FFDEBEFA442DE_341F92E58D3D507C_6041_UN,O=[N](=O)C1=C(C=C(C(=C1)NCC2=NN=C([NH]2)C3OCCC3)F)F,GQLKRPNOFPWLLT-UHFFFAOYSA-N
|
| 22965 |
+
15E3E384433B8709_BD1F3C0BF53AB7F6_6035_UN,O(C1C2CCC1C3CNCC23)C4=CC(=C(C=C4N)Cl)C,BCSAPEJHORTTEQ-UHFFFAOYSA-N
|
| 22966 |
+
170489976767C4E0_9AE353A90EE1F3CD_6039_DP,O(C2=C1OC=CC1=CC(=C2)F)C[C@H]3CNCC(O3)(C)C,IKOIYVOAQZUOHL-GFCCVEGCSA-N
|
| 22967 |
+
178B472FD9B91619_A9B72EDBA148BCEC_6039_UN,CC1=CC(=O)NC2=C1C=CC(=C2)OCCCC[S](C)(=O)=O,KVNIMLURACPCNQ-UHFFFAOYSA-N
|
| 22968 |
+
178B472FD9B91619_BB97D81EBB4A8A71_6039_UN,CC1=CC(=O)NC2=C1C=CC(=C2)OCCCC[S](C)(=O)=O,KVNIMLURACPCNQ-UHFFFAOYSA-N
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| 22969 |
+
178B472FD9B91619_DF3A1E3EE6508D9E_6039_UN,CC1=CC(=O)NC2=C1C=CC(=C2)OCCCC[S](C)(=O)=O,KVNIMLURACPCNQ-UHFFFAOYSA-N
|
| 22970 |
+
17CD799B4EFB87A5_AF479177D00314C7_6043_UN,ClCC(=O)N(CC=C)CC1=CC=C(S1)N[S](=O)(=O)CCC#C,RNMZOHFTDAXKJS-UHFFFAOYSA-N
|
| 22971 |
+
1BAF5D657C42C861_B0BD135772394C23_6035_UN,CCC1CNCCN1CC(C)OC2=C(C3=C(C=C2)C=CC=C3)Br,SMFZZTCJENSNIJ-UHFFFAOYSA-N
|
| 22972 |
+
1CCA81E83F066299_83B0C2EEBC9807CE_6041_UN,FC1=C(C(=CC=C1)NCC2(CN(C)C)CCC2)C3CC3,ZYHJAXACAIUKQK-UHFFFAOYSA-N
|
| 22973 |
+
1F5E82B408D85D99_E2134B55F80F16B0_6034_UN,CC3=NC2=C(C=C1OCCOC1=C2)N3CC4(C)CCNCC4,QOMVDIIFBIGDSS-UHFFFAOYSA-N
|
| 22974 |
+
20E650A4CCE852C1_842143DE2EAB60CF_7005_UN,COC1=C(C=CC=C1)N[S](=O)(=O)C2=CC=C3C(=C2)[NH]C(=N3)C4ONCC4,BEPXBWNMNHZLJQ-UHFFFAOYSA-N
|
| 22975 |
+
21F02BCEFDFFE38D_270E848DA1623E52_6035_UN,COCCC3(COC1=CC(=C(C(=C1)F)Br)F)CC2OC2C3,MFNVIXYFDDETQI-UHFFFAOYSA-N
|
| 22976 |
+
23786EAFC65C41BE_01258EB556631711_7022_UN,C1(=CC=C(C=C1)F)OC2CCN(CC(OCC)OCC)C2,KJKXXNMKPYRDFG-UHFFFAOYSA-N
|
| 22977 |
+
23ABB2368CFAA78B_6E9C2BE83E233E66_6031_UN,O(C(=O)C1=C[N](C=N1)C2CC2)CC3=CC(=C(C=C3)Cl)[N](=O)=O,PZCCJNJLILGWID-UHFFFAOYSA-N
|
| 22978 |
+
23DEE28048D7888D_AE26B2E361B2BD1F_6041_DP,OC(=O)C1=C(C=C(C(=C1)F)NCC2OCCCNC2)F,GHFNSZRISDLMKP-UHFFFAOYSA-N
|
| 22979 |
+
2419FA10093C970C_E061A0D4083957F4_6041_UN,FC1=C(C(=CC=C1)NC2(CN(C)C)CCCC2)C3CC3,RVACOLKWAUYHQR-UHFFFAOYSA-N
|
| 22980 |
+
24C550D2520BC1A7_5FD850D5BFBAD9A6_6026_UN,CC1=C(C(=CC=C1)C)[S](=O)(=O)N[S](C2=C(OC)C(=CC(=C2)Br)Cl)(=O)=O,NCBQWTKQCSIHFR-UHFFFAOYSA-N
|
| 22981 |
+
253EE8E7C3B4E671_DEDE8EC5E3A8CC06_7009_UN,N([S](=O)(=O)C1(CC1)C#C)C(=O)C(=O)C2=CC(=CC(=C2)Cl)Cl,REBMQRIGGMNPOI-UHFFFAOYSA-N
|
| 22982 |
+
265CFEBFB52C06D6_7E6AF67CFF4C5AA9_6026_UN,FC1=C(C(=NC=C1)F)[S](=O)(=O)N2CC(O[S](C)(=O)=O)C2,IBOMFIGBMORAPW-UHFFFAOYSA-N
|
| 22983 |
+
27FBFC0787E12987_532EBAC5387FA661_6038_UN,CC2=C(NC(C(C)[S](=O)(=O)O)=O)C(=O)N(C1=CC=CC=C1)N2C,XFMLUFNOLCJBJT-UHFFFAOYSA-N
|
| 22984 |
+
2C83574CCF0A7B34_314DB2F7674E3831_6041_UN,OC(=O)C1=CC(=C([NH]1)[N](=O)=O)NC3=CC(=C(N2CCOCC2C)C=C3)F,CVXVNGDSWQKFDX-UHFFFAOYSA-N
|
| 22985 |
+
2CF9DE5B0B40C1E0_3B8DC5DA40CB9B76_6041_UN,FC2=C(C=C1C=COC1=C2)NCC3(CCCC(C)C3)N(C)C,QFNCBDYWRHXDLH-UHFFFAOYSA-N
|
| 22986 |
+
2E79AB9B1B5BC876_7595C9681BA885C2_6039_DP,O(C2=C1OCCCOC1=CC=C2)C[C@H]3CNCC(O3)(C)C,IQHGBBYXDWMLRK-GFCCVEGCSA-N
|
| 22987 |
+
2F11E35562BF2137_FCBF2AFE1AD165B2_6031_UN,O(C(=O)CC1=N[NH]C(=N1)C2CC2)CC3=CC(=CC(=C3)I)[N](=O)=O,PSMVADHFGVNFIH-UHFFFAOYSA-N
|
| 22988 |
+
2FDEBADA4439DFFB_4945AD2E9044084A_6035_UN,O(C1CCCC12CCOCC2)C3=C(C=CC(=C3)C(C)(C)C)I,DGYBZGCLJHTGPV-UHFFFAOYSA-N
|
| 22989 |
+
310786113A7BB257_6DF7C5D462AA4BB1_6029_UN,COC1=CC(=C(C=C1)C)[S](=O)(=O)N[S](C2=CC(=CC(=C2)CC#N)Cl)(=O)=O,FLDFLFIIWVYPTD-UHFFFAOYSA-N
|
| 22990 |
+
31F8AE51FA450A27_993E840DE37536A2_6034_UN,CN4CCC1=C(C3=C(N1CC2(NCC(C)C)CCNCC2)C=CC(=C3)Cl)C4,URYDYZBFXWWKFD-UHFFFAOYSA-N
|
| 22991 |
+
33D39D73465F252E_6320AC5D4D4EFCA1_6028_UN,CCN(C1=C(C=CC=C1)C)[S](=O)(=O)N[S](C2=C(C)C=CC(=C2)Br)(=O)=O,FXTMXYHMGNLZKL-UHFFFAOYSA-N
|
| 22992 |
+
343E0D032623A107_8AA08B482919E9F3_6031_UN,O(C(=O)C2C1CCCC1ON2)CC3(CN)C(C3)C4=CC=C(C=C4)F,BJDNMDBPDKGBPY-UHFFFAOYSA-N
|
| 22993 |
+
35D222BB2DA94941_972DC83114997E8E_6035_UN,CCC1CNCCN1CC(C)OC2=C(C3=C(C=C2)C=CC=C3)F,HICUCIBCMMNSTP-UHFFFAOYSA-N
|
| 22994 |
+
3607C6554517C9DE_B3A7F892EC478905_6035_UN,COCCC3(COC1=CC(=C(C(=C1)Br)F)Br)CC2OC2C3,XNVXKDKAHZEFDX-UHFFFAOYSA-N
|
| 22995 |
+
3A2A728ADF6DB1AA_EDE51764F6ABDD98_6041_DP,OC(=O)C1=C(C2=C([NH]1)C=CC(=C2)NCC4OCC3(CNC3)C4)F,FTAPGSMLZPDYDE-UHFFFAOYSA-N
|
| 22996 |
+
3B798287A8A0A05F_9BD022D96664FD5F_6041_UN,FC1=CC(=C(C=C1)C=C)NCC2(CN(C)C)CCCC2,WIONTNHOPZZJPP-UHFFFAOYSA-N
|
| 22997 |
+
3E5DE3B692281190_A5DFD27E3B2B28EF_6038_UN,NC(=O)C1=C(C=CC(=C1)NC(=O)C2OCC[N]3C=CN=C23)[N](=O)=O,HPYGAWRFICBFOX-UHFFFAOYSA-N
|
| 22998 |
+
3F23237C4DF170BF_A404B4FFDA0B76D3_6038_DP,O(C1=CC2=C(C=C1)C=C[NH]2)C(C3CNC4(CO3)CC4)=O,LLWYPDZEZOFEOG-UHFFFAOYSA-N
|
| 22999 |
+
3F74AFAE8D562E6A_E4EDEADC0BA8EC0F_6038_UN,CN1C2CCC(C1)CC2CNC(CN3C4=C(N(C)CC3)C=C(C=C4)F)=O,RTJKSVOKGSEGLX-UHFFFAOYSA-N
|
| 23000 |
+
3FDB6DA622DF173F_34FEAFB1A1C017BD_6029_UN,CC(C)(C)[S](=O)(=O)N[S](C2=CC=C(OC1=NC=C(C)C=C1)C=C2)(=O)=O,ROQAMVDZALJPLG-UHFFFAOYSA-N
|
| 23001 |
+
40E633A8023CB101_E0F8752FFE120E15_6041_DP,COC(=O)C(=C)C1=CC(=C(C=C1)NC3CC2CNCC2C3)F,MYPZJAKPDVEJKW-UHFFFAOYSA-N
|
| 23002 |
+
410F6DB71C2F665B_189DF452F89FFC4F_6041_UN,O=[N](=O)C2=C1[NH]N=CC1=CC(=C2)NC4=C3OCCC(C3=CC=C4)=O,QJZSFLOHRWQVQN-UHFFFAOYSA-N
|
| 23003 |
+
425837CDF62C8C4F_D7E28287BCBEA225_6031_DP,O(C(=O)C1CNCC12COC2)CCOCCNCCN,HWWYLYOVRBDOBL-UHFFFAOYSA-N
|
| 23004 |
+
428E1CD6FB912352_7E1CD8753CA9B508_6026_UN,CC1=NC(=CS1)C2=CC=C(S2)[S](=O)(=O)N([S](C)(=O)=O)C3=CC(=CC=C3)[N](=O)=O,BBSIWSMHANVDBI-UHFFFAOYSA-N
|
| 23005 |
+
42BF2914932B06D0_E4B26EED03F2F7E7_7009_UN,CC1=CC(=C(C=C1)C)[S](=O)(=O)NC(C2=C(CN(C)C)C=CS2)=O,IWXHBRICVJOYQU-UHFFFAOYSA-N
|
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