Job #288 - RG2_VIRAL_2
Created at: Last updated at: Current status:
Overall Progress
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Ligand Models 1
| Name | MOLECULE 127 |
| 2D and 3D depictions |
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| SMILES | Nc2ccc1cc(S(=O)(=O)O)ccc1c2/N=N/c7ccc(/C=C/c6ccc(/C=C/c5ccc(/N=N/c3c(N)ccc4cc(S(=O)(=O)O)ccc34)cc5)cc6)cc7 |
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Ligand Models 2
| Name | MOLECULE 25 |
| 2D and 3D depictions |
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| SMILES | COC(=O)NC(C(=O)N1CCCC1c8ncc(c7ccc(c6ccc(c5ccc(c4cnc(C2CCCN2C(=O)C(NC(=O)OC)c3ccccc3)[nH]4)cc5)cc6)cc7)[nH]8)c9ccccc9 |
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Ligand Models 3
| Name | MOLECULE 78 |
| 2D and 3D depictions |
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| SMILES | O=C(OCC7OC(n5c(=O)n(c1ccccc1)c(=O)c4c(c2ccco2)cc(c3ccccc3)nc45)C(OC(=O)c6ccccc6)C7OC(=O)c8ccccc8)c9ccccc9 |
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Ligand Models 4
| Name | MOLECULE 177 |
| 2D and 3D depictions |
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| SMILES | [H][C@]%13(n1cc(C)c(=O)[nH]c1=O)C[C@H](N=N#N)[C@@H](COP(=S)(OCc%10ccc(c8c2ccc(n2)c(c3ccccc3)c4ccc([nH]4)c(c5ccccc5)c6ccc(n6)c(c7ccccc7)c9ccc8[nH]9)cc%10)OC[C@H]%12O[C@@]([H])(n%11cc(C)c(=O)[nH]c%11=O)C[C@@H]%12N=N#N)O%13 |
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Ligand Models 5
| Name | MOLECULE 20 |
| 2D and 3D depictions |
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| SMILES | Nc2c(S(=O)(=O)O)cc1cc(S(=O)(=O)O)ccc1c2/N=N/c6ccc(c5ccc(/N=N/c3c(N)c(S(=O)(=O)O)cc4cc(S(=O)(=O)O)ccc34)c(S(=O)(=O)O)c5)cc6S(=O)(=O)O |
| Model downloads | |
| Fingerprints | |