Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BDN38J
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| Binder Name |
(3S)-3-[[(2S)-2-Acetamido-3-methylbutanoyl]amino]-4-[[(2S)-1-[1-[[(3S)-2-hydroxy-5-oxooxolan-3-yl]carbamoyl]-6-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid
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| Synonyms |
CHEMBL1835399; BDBM50355103
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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 |
C31H43N5O10
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| Canonical SMILES |
CC1=CC2=C(C=C1)C(N(CC2)C(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)C)C(=O)N[C@H]3CC(=O)OC3O
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| InChI |
1S/C31H43N5O10/c1-14(2)24(32-17(6)37)28(42)33-20(12-22(38)39)27(41)35-25(15(3)4)30(44)36-10-9-18-11-16(5)7-8-19(18)26(36)29(43)34-21-13-23(40)46-31(21)45/h7-8,11,14-15,20-21,24-26,31,45H,9-10,12-13H2,1-6H3,(H,32,37)(H,33,42)(H,34,43)(H,35,41)(H,38,39)/t20-,21-,24-,25-,26?,31?/m0/s1
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| InChIKey |
MGIHOMZITTVQKS-QYKDOZOMSA-N
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| PubChem Compound ID | ||||
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