Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BK60CR
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| Binder Name |
1-(4-Tert-butylphenyl)-3-[3-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[6-(methylamino)purin-9-yl]oxolan-2-yl]methyl-propan-2-ylamino]propyl]urea
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| Synonyms |
CHEMBL2171170; BDBM50396979
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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 |
C28H42N8O4
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| Canonical SMILES |
CC(C)N(CCCNC(=O)NC1=CC=C(C=C1)C(C)(C)C)C[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)NC)O)O
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| InChI |
1S/C28H42N8O4/c1-17(2)35(13-7-12-30-27(39)34-19-10-8-18(9-11-19)28(3,4)5)14-20-22(37)23(38)26(40-20)36-16-33-21-24(29-6)31-15-32-25(21)36/h8-11,15-17,20,22-23,26,37-38H,7,12-14H2,1-6H3,(H,29,31,32)(H2,30,34,39)/t20-,22-,23-,26-/m1/s1
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| InChIKey |
ROHQGHWNUHVBHY-HUBRGWSESA-N
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| PubChem Compound ID | ||||
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