Ligand
Ligand Name:   2-(3-chloro-2-fluorophenyl)-2,3-dihydro-1,2-thiazol-3-one
Ligand Type:   non-polymer
Ligand ID:   COVPDB469 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   Fc1c(Cl)cccc1NC(=O)CCS
Standard InChI:   InChI=1S/C9H9ClFNOS/c10-6-2-1-3-7(9(6)11)12-8(13)4-5-14/h1-3,14H,4-5H2,(H,12,13)
Molecular Formula:   C9H9ClFNOS Mol. Weight:   233.00774 logP:   2.7375
HBD:   2 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
Aurora kinase A O14965 (AURKA_HUMAN) Homo sapiens (Human) 5ORL A4W Kd : 15000 nM PDBBind SHOW