Binder Information
Binder General Information | Top | |||
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Binder ID |
BL30PY
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Binder Name |
Chembl4226814
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Synonyms |
BDBM50460796
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C44H48Cl2N12O5S
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Canonical SMILES |
CCNC(=O)C1=CC2=C(N=C(N=C2S1)N)C3=CC(=C(C=C3Cl)Cl)OCCCCCCN4C=C(C=N4)C5=C6C=CNC6=NC(=N5)NC7=CC=C(C=C7)NC(=O)CCCCCCC(=O)NO
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InChI |
1S/C44H48Cl2N12O5S/c1-2-48-41(61)35-22-31-39(53-43(47)56-42(31)64-35)30-21-34(33(46)23-32(30)45)63-20-10-6-5-9-19-58-25-26(24-50-58)38-29-17-18-49-40(29)55-44(54-38)52-28-15-13-27(14-16-28)51-36(59)11-7-3-4-8-12-37(60)57-62/h13-18,21-25,62H,2-12,19-20H2,1H3,(H,48,61)(H,51,59)(H,57,60)(H2,47,53,56)(H2,49,52,54,55)
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InChIKey |
AYBXUPFMGCFRPN-UHFFFAOYSA-N
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PubChem Compound ID |
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