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CANONICAL MOLECULE
Structure of (S)-2-((2S,3R)-3-Amino-2-hydroxy-4-phenylbutanamido)-4-methylpentanoic acid
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Ubenimex

(S)-2-((2S,3R)-3-Amino-2-hydroxy-4-phenylbutanamido)-4-methylpentanoic acid
ABZ-MOL-00001317
CAS
58970-76-6
InChIKey
VGGGPCQERPFHOB-RDBSUJKOSA-N
SMILES
CC(C)C[C@@H](C(=O)O)NC(=O)[C@H]([C@@H](CC1=CC=CC=C1)N)O
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(S)-2-((2S,3R)-3-Amino-2-hydroxy-4-phenylbutanamido)-4-methylpentanoic acid
≥ 98.00% purity · RUO
Scientific intelligence · evidence
Target: Dipeptidyl peptidase 4 [chembl:CHEMBL284]
2 measured datapoints on file.
IC50 100 ug.mL-1 · assay CHEMBL666618 · CHEMBL1131945 · chembl:499995
IC50 324300 nM Abiozen-derived: weak · assay CHEMBL666618 · CHEMBL1131945 · chembl:499996
Source facts from ChEMBL (EMBL-EBI); identifiers preserved. Derived values are deterministic Abiozen computations, flagged separately. No LLM, no inference, in this data.
Bioactivity data: ChEMBL ChEMBL_37 — EMBL-EBI, used under CC BY-SA 3.0.
Canonical identity · InChIKey-keyed · one record per substance across all suppliers.