Binder Information
Binder General Information | Top | |||
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Binder ID |
BQ3J5I
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Binder Name |
Chembl4128353
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Synonyms |
BDBM50276141
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C58H108N18O17S
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Canonical SMILES |
CCCCCCCCCCNC(=O)CCCSC[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)N
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InChI |
1S/C58H108N18O17S/c1-5-6-7-8-9-10-11-16-27-65-44(81)22-18-29-94-33-42(54(89)73-41(32-77)53(88)75-47(35(3)78)55(90)68-30-45(82)67-31-46(83)70-40(57(92)93)20-13-15-26-60)74-51(86)38(21-17-28-66-58(63)64)71-49(84)34(2)69-56(91)48(36(4)79)76-52(87)39(23-24-43(62)80)72-50(85)37(61)19-12-14-25-59/h34-42,47-48,77-79H,5-33,59-61H2,1-4H3,(H2,62,80)(H,65,81)(H,67,82)(H,68,90)(H,69,91)(H,70,83)(H,71,84)(H,72,85)(H,73,89)(H,74,86)(H,75,88)(H,76,87)(H,92,93)(H4,63,64,66)/t34-,35+,36+,37-,38-,39-,40-,41-,42-,47-,48-/m0/s1
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InChIKey |
DOYHZVWOLDYJLK-NPQRDTPESA-N
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PubChem Compound ID |
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