Added 59 molecules from epoch 15522 for P31645
Browse files- P31645_molecules.csv +59 -0
P31645_molecules.csv
CHANGED
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@@ -8152,3 +8152,62 @@ F1AE6B039EE88D4F_514D43DF4FDC18C8_6041_UN,CN4CCC1=C(C=CC=C1NCC3=C2OCCCOC2=CC=C3)
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| 8152 |
F7CABF1810A708EA_EE01B1E32C831097_6041_UN,C1(=CC=C(C=C1)C2OCCO2)NC3=C(N(C)C)C=CC(=C3)F,UAPLZFICGMEJQQ-UHFFFAOYSA-N
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| 8153 |
F9986C32146F365C_8A588D8A2B6E62B7_6026_UN,FC1=C(C=CC(=C1)[S](=O)(=O)N4CCOC(C2=NC(=NO2)C3CC3)C4)C#N,WLHXFNLXCUZFKZ-UHFFFAOYSA-N
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| 8154 |
FE0A516A80E71112_45CF6F750B99EDCC_6041_UN,CN4CCC1=C(N=C(S1)NC2=C3C(=CC=C2)OC=C3)C4,AKGBRTNARIPROX-UHFFFAOYSA-N
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| 8152 |
F7CABF1810A708EA_EE01B1E32C831097_6041_UN,C1(=CC=C(C=C1)C2OCCO2)NC3=C(N(C)C)C=CC(=C3)F,UAPLZFICGMEJQQ-UHFFFAOYSA-N
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| 8153 |
F9986C32146F365C_8A588D8A2B6E62B7_6026_UN,FC1=C(C=CC(=C1)[S](=O)(=O)N4CCOC(C2=NC(=NO2)C3CC3)C4)C#N,WLHXFNLXCUZFKZ-UHFFFAOYSA-N
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| 8154 |
FE0A516A80E71112_45CF6F750B99EDCC_6041_UN,CN4CCC1=C(N=C(S1)NC2=C3C(=CC=C2)OC=C3)C4,AKGBRTNARIPROX-UHFFFAOYSA-N
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| 8155 |
+
017D81A8650F2477_97671074A13A7DD5_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)C3=C[N](N=N3)C4CCOCC4,ZYOLBGBLLGQGQC-UHFFFAOYSA-N
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| 8156 |
+
0347236E81D82BA0_F86816276818B4B4_7019_UN,C(C2C1CC3CC(C1)CC2C3)=CC5=NC4=C(CC)C=CC=C4C=C5,AGGWNBXGHUAFGY-UHFFFAOYSA-N
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| 8157 |
+
0D72D50229D3C14C_94F2AFA47292400F_6041_UN,C[Si](C)(C)C1=C(C=CC=N1)NC2=CC4=C(C=C2)OC3(CCCCC3)O4,GRRIAEKJAASTGH-UHFFFAOYSA-N
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| 8158 |
+
1098D414994499E6_0B60D3F19A141AE3_7019_UN,C(C(=O)NC2C1CC3CC(C1)CC2C3)=CCC4=CC=C([N](=O)=O)C=C4,LAVQLAOXXPFXHG-UHFFFAOYSA-N
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| 8159 |
+
2CB6E38F7B1881A4_E14719F337EC53D9_6038_UN,N(C2=C1[NH]C=CC1=CC=C2)C(=O)C4=CN3C(=NCC3)C=C4,OPMAFYCNNIUTOX-UHFFFAOYSA-N
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| 8160 |
+
3759D75CF831186B_BDB78CCEF85606D0_6034_UN,C=CC2=NC1=C(C=CC=C1)C(=O)N2CC34CCC(CC3)(C(F)(F)F)CC4,LNAVVHRMSCVJCW-UHFFFAOYSA-N
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| 8161 |
+
3A4BC750D8BCEB2A_5D4D79F0943A9AA0_6038_DP,S(C1=CC2=C(C=C1)[NH]N=C2)C(C3=CC=CC4=C3CNCCO4)=O,KQFNVDIYOIJQLS-UHFFFAOYSA-N
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| 8162 |
+
3CC52B1ACB413E70_3BB2666A36913654_6038_DP,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3(CCNCC3)[S](=O)(=O)C)=O,NJCJGGRPFJAQRZ-UHFFFAOYSA-N
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| 8163 |
+
3E385D3A47461723_CB156633CA1CF690_6041_UN,C[Si](C)(C)C1=C(C=CC=C1)NC2=CC4=C(C=C2)OC3(CCC3)C=C4,XRBTVJIVZHRVSM-UHFFFAOYSA-N
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| 8164 |
+
46B0B575AD38986A_BE08F07D263319C1_6043_UN,C2(=C1OC=CC1=CC=C2)N[S](C4=CC3=C(C=CC(=C3)OC)CC4)(=O)=O,LSBJSYCNSYJXLJ-UHFFFAOYSA-N
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| 8165 |
+
4A8371E2E19D56F6_0905D0D8FC8B06C9_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3CCN([S](NC)(=O)=O)CC3)=O,SQDHIOFFHYMFMO-UHFFFAOYSA-N
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| 8166 |
+
4BAE139F69DD8A94_FC0678387327CAE7_6039_UN,CCOC4CC(OCC1=CC(=CC2=C1OC(OC2)C3=CSC=C3)F)C45CCCC5,LRRRMZJJDQYGTK-UHFFFAOYSA-N
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| 8167 |
+
4BFE006B655DD392_95B5E22B3CEDF0C7_7017_UN,NC1=CC2=C(C=C1)C(=CC=C2)[S](=O)(=O)N3C5(CI)CC4CC(CC3C4)C5,UZTHKLFSFITART-UHFFFAOYSA-N
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| 8168 |
+
51BC493EC1F12056_FEFCF86F9F03D275_7015_UN,CN(CC1=CC2=C(C=C1)C=C(OC)C=C2)[S](=O)(=O)C4=C3N=CC=CC3=CC=C4,NEWNPINONHHHNH-UHFFFAOYSA-N
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| 8169 |
+
524CCAFBFA656DB7_72680D374878D00E_6043_UN,CC1=CC(=C(C=C1)C#N)N[S](C2=CC(=CC(=C2)COC)Cl)(=O)=O,ZBWQPLBDHBKREQ-UHFFFAOYSA-N
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| 8170 |
+
57F9FDC4BF3D483B_BD4177714D2E4056_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)C3=C([NH]C=C3)C4CCC4,URKVLXPZBDPMBB-UHFFFAOYSA-N
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| 8171 |
+
626199D20023B60C_6E4CD8429E76E6B5_6031_UN,O(C(=O)C1=CC2=C(C=C1)[NH]C3=C2CNCC3)CC4CC5CC4C=C5,CCMIOQMVKHXNJM-UHFFFAOYSA-N
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| 8172 |
+
641241450EFF5E15_273883A07C939DF5_6041_UN,COCCC1=CC=C(C=C1)NC3=C2CCN([S](C)(=O)=O)C2=CC=C3,VNXMMGRAOYTMPM-UHFFFAOYSA-N
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| 8173 |
+
68276B1CBE2497D7_F2868D00C0625114_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(CN3C(C)CCC3)=O,XIVRUVRBXJDRKI-UHFFFAOYSA-N
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| 8174 |
+
6D1E82697C2C940D_C9398D6C2DB0DE0E_6038_DP,S(C1=CC2=C(C=C1)C=CC=C2)C(C3=N[NH]C4=C3CNCC4)=O,NIINRYWWPSDQKO-UHFFFAOYSA-N
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| 8175 |
+
6F9975A34997CA36_8E3222622A59B0E3_6041_UN,O=[N](=O)C1=CC4=C(C(=C1)NC2=CC=CC3=C2N(C)CCO3)C=N[NH]4,XNJHJHNOGUBAEY-UHFFFAOYSA-N
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| 8176 |
+
7772D5111D654A0D_A2359F8AFBB09878_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3=C(C)N=C(S3)C4CCCO4)=O,LLQIDJDMSCRQRX-UHFFFAOYSA-N
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| 8177 |
+
7CB6648B520B277C_AE81CD1C5EBCF993_6041_UN,C1(=CC(=NC=C1)N2CCOCC2)NCCC3=CC=C([Si](C)(C)C)C=C3,QIFULBWCHSGQMU-UHFFFAOYSA-N
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| 8178 |
+
7D0589F02D9A5479_361CD9C164AD43FC_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)CC3=CC=C(C=C3)[S](=O)(=O)F,DVOHIWTUQMUDAM-UHFFFAOYSA-N
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| 8179 |
+
7D1F3A89D0EAB140_6AB01A1D8BE94242_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)C4=C3OC(CC3=CC=C4)=O,MRZCPOFZMKPGCO-UHFFFAOYSA-N
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| 8180 |
+
822D306ADAACB96D_A28D6A86B78CEC18_6041_UN,COC1=C(C=C(C(=C1)NCCC2=CC(=CC(=C2)OC)C)[N](=O)=O)C,DRQYZQVPUUCEBU-UHFFFAOYSA-N
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| 8181 |
+
8702B55567578CD3_4E8C384A05B08A50_7022_UN,C1(=C(C2=C(C=C1)OCO2)F)OCC(CC)C3=CC4=C(C=C3)CCCC4,LOOASKINXQVRBX-UHFFFAOYSA-N
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| 8182 |
+
87DD4346BBEF8178_F91258985EF47AB9_6041_UN,C1(=NC=CC(=C1)C2CC2)NCC3=CC=C(C(C)(C)C)O3,TXISDIFMMFAZSI-UHFFFAOYSA-N
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| 8183 |
+
8F15E0AF919C45AF_6B55A36D93C1C8DB_6038_DP,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3=C[NH]N=C3C4CCCNC4)=O,DOPQLPSARGMDBC-UHFFFAOYSA-N
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| 8184 |
+
96E42C9C4B8F186E_6E7EE3EE85619AD5_6035_DP,COC1=CC(=CC=C1)C2NCC(C2)OC3=CC4=C(C=C3)CNCCO4,WIEUZRQIAKTSQJ-UHFFFAOYSA-N
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| 8185 |
+
979B3F800C538B4B_6EC3081E89C15399_6041_UN,COCOC1=CC(=CC(=C1)F)NCC2(CCOCC2)C3=CC4=C(C=C3)OCO4,MYEASUKWZHRVTL-UHFFFAOYSA-N
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| 8186 |
+
9A8575243169D1C9_8CE54765B71D3FDC_6035_DP,CC[C@H](OC2=CC1=C(CCNCC1)C=C2)C3=CC(=CC=C3)[N](=O)=O,PMDBXIWRWAVJEF-IBGZPJMESA-N
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| 8187 |
+
9B40EA791272117B_24BBD1BC730FCCA3_6026_UN,CC1=CC2=C(C=C1)C=C(C=C2)[S](=O)(=O)N4CC(C3=CC(=C(C=C3)F)OC)C4,LWPBYWAOHLPMJR-UHFFFAOYSA-N
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| 8188 |
+
9DCDAF16534F7946_78509E01E7193F4C_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3=C(CSC)C=CC=N3)=O,BTGDEMCAAPDCAN-UHFFFAOYSA-N
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| 8189 |
+
A0D4350D6E0F66B7_84E1D21E1359AAC5_6041_UN,COCOC1=C(C=C(C=C1F)F)NCC2(CC2)C3=CC4=C(C=C3)OCO4,GDQZSGLKDXVMOP-UHFFFAOYSA-N
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| 8190 |
+
A21F65905406C859_6A5A461670527EE9_6043_UN,CC1=C(C(=CC=C1)CC#N)N[S](C2=CC(=CC(=C2)COC)Cl)(=O)=O,OEXOGMFNVROEMR-UHFFFAOYSA-N
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| 8191 |
+
A3B7AFF2A4378160_0472A26D941930C1_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)C3CCCC4CCCCC34,LKFYAOUBLVLINB-UHFFFAOYSA-N
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| 8192 |
+
AC8CD25B55B41E67_413BFFB9B2DE0CC3_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3=CC(NC4=C3[N](C)C=N4)=O)=O,LAFHQPKDQJTTSV-UHFFFAOYSA-N
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| 8193 |
+
AEED81F3CACB2E58_FB62362B859E37FE_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)C3=CN=C(C#N)S3,OGQNQHRXABSFMW-UHFFFAOYSA-N
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| 8194 |
+
AFD7AD6439773708_CF2907DBAE386A76_6038_DP,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3(NC)CCC3)=O,MORLSXWDMHVUDX-UHFFFAOYSA-N
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| 8195 |
+
B32F37F50CB7D85E_25724FB8700BA428_6041_UN,C1(=C(C=CS1)C2CC2)N[C@@H]3CCN(CC)[C@H]3C4=CC(=C(C(=C4)F)F)F,FIIBVSVVVZLDDB-AEFFLSMTSA-N
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| 8196 |
+
B4C232260A4BB3B6_79BEFF65C87609B9_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3=CC(=C(C)C=C3)[S](=O)(=O)F)=O,HXYANTHNTACSBB-UHFFFAOYSA-N
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| 8197 |
+
B99578E802A6DBD8_092DD9B208891DDD_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(CCC(C)=C)=O,JQGMSTZLCJSIMX-UHFFFAOYSA-N
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| 8198 |
+
BAD05517316F69B2_9535152DDD12A708_6038_DP,N(C1=CC2=C(C=C1)SC3=NCCN23)C(C5C4=C[NH]N=C4CN5)=O,ZBFZGHGAGZXYIC-UHFFFAOYSA-N
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| 8199 |
+
BBF176845236CD53_C81D587122C25C78_6041_UN,COC1=C(C=CC(=C1)[N](=O)=O)NCC2=CC(=C(C=C2)F)COC,FHCKDUSYKWQANQ-UHFFFAOYSA-N
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| 8200 |
+
BE226EE43BFFF567_FBD76F3C73C2E38B_6039_UN,O(CC1(CC=C)CCCCC1)CC3=CC(=C2OCOC2=C3)C4CC4,VBCJHTHGBVGTKK-UHFFFAOYSA-N
|
| 8201 |
+
BF567A4457B8964F_0248506A9A099E0A_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C([C@@H](C(C)C)N[S](=O)(=O)C3CC3)=O,ZBACCEDPSCXYAB-MRXNPFEDSA-N
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| 8202 |
+
C410DF9A94BEC187_D2AA2BC6FA4FD419_6035_UN,CC3(C)[C@@H](OC2=C1C=CC=CC1=NC=C2)[C@H]4CCCN[C@@H]34,LBOMECDCQBPCJS-XKQJLSEDSA-N
|
| 8203 |
+
C4DB1A1EC31B1C95_F0398DCBD57111E8_6035_UN,C[C@]45CC[C@H]2[C@@H](CC=C3C[C@@H](OC1=C(C)C=C(C=C1Br)Cl)CC[C@]23C)[C@@H]4CC=C5C6=CN=CC=C6,JIAAXALHISRNJF-FYKWJRINSA-N
|
| 8204 |
+
C5B13141AFE50451_760F429296BB7417_6041_UN,C1(=NC=CC(=C1)N2CCOCC2)NCCC3=CC=C([Si](C)(C)C)C=C3,YVNIPDLEHOOSIE-UHFFFAOYSA-N
|
| 8205 |
+
CD9C6B1500481F6C_A91FDC29F6339AFF_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(=O)C4=C(C=C3N=C[NH]C3=C4)F,PJDTYGQGFFCUOK-UHFFFAOYSA-N
|
| 8206 |
+
CE6E48766DA56BEC_4A2E9BE26DB256EC_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C3=C(C)N=C(S3)C4CCOC4)=O,LIQDIPOMQDFEAU-UHFFFAOYSA-N
|
| 8207 |
+
DD7A010EA124A47E_A23099BC4EDD48A4_6038_DP,N(C1=CC2=C(C=C1)N=CS2)C(C3C4=C(CN3)N=CN=C4)=O,PYXBBBKPMOENOE-UHFFFAOYSA-N
|
| 8208 |
+
DF19E5E3FFCF8D1F_AE90E1E8519C2E56_6029_UN,N(C1=C(C=CC=C1)CN2CCOCC2)[S](C3=CC4=C(C=C3)C=C[NH]4)(=O)=O,XJLPMRFBRFYFIJ-UHFFFAOYSA-N
|
| 8209 |
+
E4C752F270D7E660_32A1D8B4FCAA54E6_6034_UN,COC1=CC2=C(C=C1)N(C=C2C3=CCNCC3)CC45CC(CC)(C4)CO5,NJKRDHOCLYFHAW-UHFFFAOYSA-N
|
| 8210 |
+
E5F1BEC3690C3FE7_544DC41F03B0A65D_6026_UN,COC1=CC(=CC=C1)[S](=O)(=O)NC2=C(CCN(C)C)C=CC=C2,UAQXWDZANPMTCG-UHFFFAOYSA-N
|
| 8211 |
+
EFF82656BBD0CFB7_95C23F819FE1A8AA_6039_UN,COC(OC)C1=CC(=C(C=C1)F)COCC4CC2(CC3(C2)OCCO3)CO4,NCAHZOORXPJSDN-UHFFFAOYSA-N
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| 8212 |
+
F527AD5A0B98719E_4593ACEA199B9ED6_6038_UN,N(C2=C(C=C1OCCCOC1=C2)[N](=O)=O)C(C4=C3OCC(C)C3=CC=C4)=O,HFZYKVKXDKCYRJ-UHFFFAOYSA-N
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| 8213 |
+
F65043729C7B5B33_E904F51D6ABD0593_6041_UN,O=[N](=O)C1=CC4=C(C(=C1)NC3C2=C(C=C(OC)C=C2)OCC3)C=N[NH]4,DHBIWXKAMCHFLL-UHFFFAOYSA-N
|