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Attributes

UniProt ID
Protein Name
Sigma intracellular receptor 2
Ligand Name
Roluperidone
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RNRYULFRLCBRQS-UHFFFAOYSA-N
SMILES
c1ccc2c(c1)CN(C2=O)CC3CCN(CC3)CC(=O)c4ccc(cc4)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 7M94
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Color Legend
Unassigned regionsLigand / hetero atomse7m94A1e7m94B1e7m94C1e7m94D1
ECOD domains from experimental PDB structures interacting with ligand DB13080
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q3MHW7DB13080YT77m94e7m94A1A:2-168
Q3MHW7DB13080YT77m94e7m94B1B:3-167
Q3MHW7DB13080YT77m94e7m94C1C:4-168
Q3MHW7DB13080YT77m94e7m94D1D:3-168