Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BY0PH8
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| Binder Name |
(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-Acetamidopent-4-enoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]-6-aminohexanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-5-amino-5-oxopentanoyl]amino]acetyl]amino]-N-[(2S)-1-[[(2S)-1-amino-1-oxopent-4-en-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]pentanediamide
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| Synonyms |
CHEMBL1684376; BDBM50338748
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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 |
C59H94N22O14
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| Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC2=CN=CN2)C(=O)N[C@@H](CCC(=O)N)C(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC3=CN=CN3)C(=O)N[C@@H](CC=C)C(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC=C)NC(=O)C
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| InChI |
1S/C59H94N22O14/c1-6-13-36(49(63)86)74-54(91)42(25-34-27-66-30-70-34)78-52(89)40(19-21-46(62)84)73-47(85)29-69-50(87)39(18-20-45(61)83)76-55(92)43(26-35-28-67-31-71-35)79-56(93)44-17-12-24-81(44)58(95)41(15-9-10-22-60)77-57(94)48(32(4)8-3)80-53(90)38(16-11-23-68-59(64)65)75-51(88)37(14-7-2)72-33(5)82/h6-7,27-28,30-32,36-44,48H,1-2,8-26,29,60H2,3-5H3,(H2,61,83)(H2,62,84)(H2,63,86)(H,66,70)(H,67,71)(H,69,87)(H,72,82)(H,73,85)(H,74,91)(H,75,88)(H,76,92)(H,77,94)(H,78,89)(H,79,93)(H,80,90)(H4,64,65,68)/t32-,36-,37-,38-,39-,40-,41-,42-,43-,44-,48-/m0/s1
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| InChIKey |
QFUIDWXJAPEKST-DJPYLBTISA-N
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| PubChem Compound ID | ||||
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