BDBM77546 4-(ethylamino)-3-nitro-1-benzopyran-2-one::4-(ethylamino)-3-nitro-chromen-2-one::4-(ethylamino)-3-nitro-coumarin::4-(ethylamino)-3-nitrochromen-2-one::MLS000710239::SMR000279075::cid_2831623

SMILES CCCC(=O)OCCC1CC[C@@]2(C)C(C1)[C@@H](O)C[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

InChI Key InChIKey=RZALPUUXZXOVSF-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 77546   

TargetSodium/potassium-transporting ATPase subunit alpha-1(Dog)
Vanderbilt Screening Center For Gpcrs, Ion Channels and Transporters

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 77546BDBM77546(2-(6alpha-hydroxy-17-oxoandrostane-3-yl)ethyl buty...)
Affinity DataIC50: 1.00E+5nMAssay Description:Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/4/2026
Entry Details
US Patent