Covpdb









Ligand
Ligand Name:   RU78300
Ligand Type:   non-polymer
Ligand ID:   COVPDB170 PubChem:   5287488
Synonym(s):  
  •   chembl25186
  • 2-formyl-6-methoxyphenyl dihydrogen phosphate
  • fragment 9
  • bdbm14679
  • db03306
  • 2-formyl-6-methoxyphenoxyphosphonic acid
  • phosphoric acid 2-formyl-6-methoxyphenyl ester
  • q27094234
show 7 synonym(s)
DrugBank:   DB03306 ChEMBL:   CHEMBL25186
Canonical SMILES:   COc1cccc(C=O)c1OP(O)(O)=O
Standard InChI:   InChI=1S/C8H9O6P/c1-13-7-4-2-3-6(5-9)8(7)14-15(10,11)12/h2-5H,1H3,(H2,10,11,12)
Molecular Formula:   C8H9O6P Mol. Weight:   232.01367 logP:   0.9792
HBD:   2 HBA:   4
#Rotatable Bonds:   4 TPSA:   93.06

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Proto-oncogene tyrosine-protein kinase Src P12931 (SRC_HUMAN) Homo sapiens (Human) 1O41 300 IC50 : 95000-900000 nM, IC50 : 900000 nM, IC50 : 95000 nM BindingDB SHOW