Ligand |
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Ligand Name: PCM-0103050 | ||
Ligand Type: non-polymer | ||
Ligand ID: COVPDB972 | PubChem: 50988901 | |
Synonym(s):
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DrugBank: - | ChEMBL: - | |
Canonical SMILES: ClCC(=O)NCc1cc(Br)cs1 | ||
Standard InChI: InChI=1S/C7H7BrClNOS/c8-5-1-6(12-4-5)3-10-7(11)2-9/h1,4H,2-3H2,(H,10,11) | ||
Molecular Formula: C7H7BrClNOS | Mol. Weight: 266.91202 | logP: 2.3656 |
HBD: 1 | HBA: 2 | |
#Rotatable Bonds: 3 | TPSA: 29.1 |
Bound Proteins |
Protein Name | Uniprot ID/ACC | Organism | PDB ID | HET Code | Binding Affinity | Binding Database | Complex Card |
Ubiquitin thioesterase OTUB2 | Q96DC9 (OTUB2_HUMAN) | Homo sapiens (Human) | 5QIQ | J5A |
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