Attributes
UniProt ID
Protein Name
Caspase-3
Ligand Name
(3S)-3-({[(5S,10aS)-2-{(2S)-4-carboxy-2-[(phenylacetyl)amino]butyl}-1,3-dioxo-2,3,5,7,8,9,10,10a-octahydro-1H-[1,2,4]triazolo[1,2-a]cinnolin-5-yl]carbonyl}amino)-4-oxopentanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BGEXQSKGWCDSIQ-MLCQCVOFSA-N
SMILES
CC(=O)C(CC(=O)O)NC(=O)C1C=C2CCCCC2N3N1C(=O)N(C3=O)CC(CCC(=O)O)NC(=O)Cc4ccccc4
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3KJF
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Color Legend
Unassigned regionsLigand / hetero atomse3kjf.1