Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BY05VS
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| Binder Name |
3-[(2S,5S,8S,14R)-5-[3-(Carbamoylamino)propyl]-14-[(4-hydroxyphenyl)methyl]-8-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propylurea
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| Synonyms |
CHEMBL2179710; BDBM50398989
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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 |
C36H45N9O8
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| Canonical SMILES |
C1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC3=CC=CC=C3C=C2)CCCNC(=O)N)CCCNC(=O)N)CC4=CC=C(C=C4)O
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| InChI |
1S/C36H45N9O8/c37-35(52)39-15-3-7-26-32(49)43-27(8-4-16-40-36(38)53)33(50)45-28(19-22-9-12-23-5-1-2-6-24(23)17-22)31(48)41-20-30(47)42-29(34(51)44-26)18-21-10-13-25(46)14-11-21/h1-2,5-6,9-14,17,26-29,46H,3-4,7-8,15-16,18-20H2,(H,41,48)(H,42,47)(H,43,49)(H,44,51)(H,45,50)(H3,37,39,52)(H3,38,40,53)/t26-,27-,28-,29+/m0/s1
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| InChIKey |
XSWHWVYBODETDD-XFTNXAEASA-N
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| PubChem Compound ID | ||||
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