Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BHSJ53
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| Binder Name |
3'-[3-[3-(Trifluoromethyl)-4-chlorophenyl]thioureido]-5'-O-trityl-3'-deoxythymidine
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| Synonyms |
CHEMBL1092055; BDBM50314846
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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 |
C37H32ClF3N4O4S
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| Canonical SMILES |
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)NC(=S)NC6=CC(=C(C=C6)Cl)C(F)(F)F
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| InChI |
1S/C37H32ClF3N4O4S/c1-23-21-45(35(47)44-33(23)46)32-20-30(43-34(50)42-27-17-18-29(38)28(19-27)37(39,40)41)31(49-32)22-48-36(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-19,21,30-32H,20,22H2,1H3,(H2,42,43,50)(H,44,46,47)/t30-,31+,32+/m0/s1
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| InChIKey |
DMHANHXEZBTSGC-DCMFLLSESA-N
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| PubChem Compound ID | ||||
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