Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B1DQZ4
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| Binder Name |
(4S)-4-Amino-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[2-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S,3S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-5-oxopentanoic acid
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| Synonyms |
CHEMBL262404; BDBM50219318
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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 |
C70H116N22O20
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| Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CC2=CN=CN2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)N
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| InChI |
1S/C70H116N22O20/c1-15-36(10)56(69(111)90-47(21-35(8)9)68(110)92-57(40(14)93)70(112)85-44(58(73)100)18-32(2)3)91-54(97)29-77-60(102)38(12)82-61(103)39(13)83-64(106)49(23-42-26-75-31-80-42)89-67(109)50(24-51(72)94)84-53(96)28-76-59(101)37(11)81-52(95)27-78-63(105)48(22-41-25-74-30-79-41)88-66(108)46(20-34(6)7)87-65(107)45(19-33(4)5)86-62(104)43(71)16-17-55(98)99/h25-26,30-40,43-50,56-57,93H,15-24,27-29,71H2,1-14H3,(H2,72,94)(H2,73,100)(H,74,79)(H,75,80)(H,76,101)(H,77,102)(H,78,105)(H,81,95)(H,82,103)(H,83,106)(H,84,96)(H,85,112)(H,86,104)(H,87,107)(H,88,108)(H,89,109)(H,90,111)(H,91,97)(H,92,110)(H,98,99)/t36-,37-,38-,39-,40+,43-,44-,45-,46-,47-,48-,49-,50-,56-,57-/m0/s1
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| InChIKey |
NCXUXUKCCASIQQ-SZLTWBEZSA-N
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| PubChem Compound ID | ||||
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