Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BEHV02
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| Binder Name |
1-[(2R,4S,5S)-4-[2-(3,4-Dimethoxyphenyl)-1,3-dithian-2-yl]-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
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| Synonyms |
CHEMBL4088260; BDBM50268185; 3'-[2-(3,4-Dimethoxyphenyl)-1,3-dithiane-2-yl]-3'-deoxythymidine
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C22H28N2O6S2
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| Canonical SMILES |
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)C3(SCCCS3)C4=CC(=C(C=C4)OC)OC
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| InChI |
1S/C22H28N2O6S2/c1-13-11-24(21(27)23-20(13)26)19-10-15(18(12-25)30-19)22(31-7-4-8-32-22)14-5-6-16(28-2)17(9-14)29-3/h5-6,9,11,15,18-19,25H,4,7-8,10,12H2,1-3H3,(H,23,26,27)/t15-,18+,19+/m0/s1
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| InChIKey |
MPYHEQDQXUBTRL-KFKAGJAMSA-N
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| PubChem Compound ID | ||||
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