BDBM50500144 CHEMBL2086792

SMILES c1ccc2c(c1)c(c[nH]2)C(=S)N3CCC(CC3)O

InChI Key InChIKey=VTQVMVULAOZKHG-UHFFFAOYSA-N

Data  1 Kd

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50500144   

TargetGTPase KRas(Human)
Stony Brook University

Curated by ChEMBL
LigandPNGBDBM50500144(CHEMBL2086792)
Affinity DataKd:  4.20E+5nMAssay Description:Binding affinity to KRAS (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/4/2020
Entry Details Article
PubMedPDB3D3D Structure (crystal)