smiles
stringlengths 11
172
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| 30
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(OC)C3=CC(=CC=C3)OC)=O
|
1BA7E70BA7C75F10_03DBCE9E2C8C79DA_6038_UN
| 29
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCC(=O)C3=C(C=CC=C3F)F
|
9F5E50F23B60AE3A_D324CFDCC2EE2C2B_6038_UN
| 30
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=NOC4=C3C=CC(=C4)F
|
AB6AE0C508A496D0_5E199B07AC241B7F_6038_UN
| 28
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C[N]4C=C([C@@H]3CNC[C@H]3OC)N=N4)=O
|
06AACF034199EF2A_A0182C4D78333B40_6038_DP
| 31
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C([C]4(C(OC)=O)C[C]3(C[CH2]C3)C4)=O
|
A98D9158CFBBD4BE_6189E28F8302D0C9_6038_UN
| 29
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3)[N]4N=NN=C4N)=O
|
7154312347B13C50_6C9E60B70A44603A_6038_UN
| 30
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=C(C(=NC=C3)F)Cl
|
4E159CA63992F118_D4A4F043A64476A6_6038_UN
| 26
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C)[N](C(=C3)C)C4=N[N](C=C4)C)=O
|
5A7F7B5BC4BD656B_7EF5C0A66ADEAB01_6038_UN
| 31
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C[N]3C=C(C=N3)C4CC4
|
CD8A3DF417A0006C_75D3ED1104D0D186_6038_UN
| 27
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C[C@@H]3C[C@H]3C4=CC=C(OC)C=C4)=O
|
B5CF2FC18937884F_BE0530B83DFA5FBF_6038_UN
| 30
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CC3CCCC4=C3C=C(C(OC)=O)C=C4)=O
|
198D7249711B03EF_6E1CE17C5F5B437F_6038_UN
| 33
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)[C@H]3CC[C@@H](CC3)C4CCC4
|
7E543C7BF2C6301C_AD64AFCD9E3DAADF_6038_UN
| 28
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C=CCC)=O
|
3ADDDB70D2A38CCE_B0E851D0EE3F6ABD_6038_UN
| 22
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(CN3CC(OC)(C3)C)=O
|
CFD3A88D4715218C_2C2450EB980E095E_6038_UN
| 26
|
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