Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B3VTH6
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| Binder Name |
Methyl (2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-benzamidoacetyl)amino]-3-phenylpropanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-6-(2-bicyclo[2.2.1]heptanylamino)hexanoyl]amino]-3-hydroxypropanoate
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| Synonyms |
CHEMBL3932467; BDBM50194427
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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 |
C44H63N7O9
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| Canonical SMILES |
C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC1CC2CCC1C2)C(=O)N[C@@H](CO)C(=O)OC)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)CNC(=O)C4=CC=CC=C4
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| InChI |
1S/C44H63N7O9/c1-27(2)21-35(43(58)49-33(41(56)51-37(26-52)44(59)60-4)17-11-12-20-45-34-24-30-18-19-32(34)22-30)50-39(54)28(3)47-42(57)36(23-29-13-7-5-8-14-29)48-38(53)25-46-40(55)31-15-9-6-10-16-31/h5-10,13-16,27-28,30,32-37,45,52H,11-12,17-26H2,1-4H3,(H,46,55)(H,47,57)(H,48,53)(H,49,58)(H,50,54)(H,51,56)/t28-,30?,32?,33-,34?,35-,36-,37-/m0/s1
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| InChIKey |
KIVRLNZVHYCJSN-CEIAAXPSSA-N
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| PubChem Compound ID | ||||
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