Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B73ZKJ
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| Binder Name |
(3S)-4-[[(2R)-1-[[(2R)-1-[[(2S)-1-[[(2S)-5-Amino-1-[[(2S)-6-amino-1-[[(2S,3R)-1-[[(2R)-1-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-[[(2S)-1-[(2S)-4-methyl-2-[[(2S)-1-[(2S)-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]pentanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid
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| Synonyms |
CHEMBL2370375
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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 |
C58H96N18O20S3
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| Canonical SMILES |
C[C@H]([C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]3CCC(=O)N3)O
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| InChI |
1S/C58H96N18O20S3/c1-27(2)21-34(69-53(91)40-12-7-19-75(40)55(93)32-14-16-42(80)64-32)56(94)76-20-8-11-39(76)52(90)68-33(22-43(81)82)48(86)71-37(25-98)51(89)72-36(24-97)49(87)66-30(10-6-18-63-58(61)62)45(83)67-31(13-15-41(60)79)46(84)65-29(9-4-5-17-59)47(85)74-44(28(3)78)54(92)73-38(26-99)50(88)70-35(23-77)57(95)96/h27-40,44,77-78,97-99H,4-26,59H2,1-3H3,(H2,60,79)(H,64,80)(H,65,84)(H,66,87)(H,67,83)(H,68,90)(H,69,91)(H,70,88)(H,71,86)(H,72,89)(H,73,92)(H,74,85)(H,81,82)(H,95,96)(H4,61,62,63)/t28-,29+,30+,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,44+/m1/s1
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| InChIKey |
VZXITKGZPXBLNH-OPCQSDTLSA-N
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| PubChem Compound ID | ||||
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