Ligand
Ligand Name:   4-(DIMETHYLAMINO)BENZOIC ACID
Ligand Type:   peptide-like
Ligand ID:   COVPDB1470 PubChem:   12092
Synonym(s):  
  •   4-dimethylaminobenzoic acid
  • 619-84-1
  • benzoic acid, 4-(dimethylamino)-
  • n,n-dimethyl-p-aminobenzoic acid
  • benzoic acid, p-(dimethylamino)-
  • n,n-dimethyl-4-aminobenzoic acid
  • p-n,n-(dimethylamino)benzoic acid
  • p-dimethylaminobenzoic acid
  • p-dimethylamino benzoic acid
  • mfcd00002537
  • 4-dimethylamino-benzoic acid
  • unii-d1ma908ev0
  • nsc 16596
  • p-(dimethylamino)benzoic acid
  • 4-(n,n-dimethylamino) benzoic acid
  • d1ma908ev0
  • 4-dimethylaminobenzoic acid, 98%
  • 4-dimethylamino benzoic acid
  • 4-dimethylaminobenzoicacid
  • einecs 210-615-8
  • acmc-209myi
  • 4dimethylaminobenzoic acid
  • schembl33368
  • chembl112322
  • dtxsid7060708
  • hms3604d07
  • zinc388582
  • 4-dimethylaminophenylcarboxylic acid
  • nsc16596
  • anw-34024
  • bbl027388
  • nsc-16596
  • sbb040528
  • stl169142
  • 4-(dimethylamino)benzoic acid, 98%
  • akos000119548
  • cs-w019576
  • db08748
  • gs-3079
  • mcule-2235235718
  • ac-11462
  • ak-41190
  • l710
  • sy020179
  • d0724
  • ft-0618360
  • st50213889
  • m-6385
  • ae-562/40174962
  • w-105063
  • 4-(dimethylamino)benzoic acid, 90%, technical grade
  • q27097934
  • f2191-0087
show 52 synonym(s)
DrugBank:   DB08748 ChEMBL:   CHEMBL112322
Canonical SMILES:   CN(C)c1ccc(cc1)C(O)=O
Standard InChI:   InChI=1S/C9H11NO2/c1-10(2)8-5-3-7(4-6-8)9(11)12/h3-6H,1-2H3,(H,11,12)
Molecular Formula:   C9H11NO2 Mol. Weight:   165.07898 logP:   1.4508
HBD:   1 HBA:   2
#Rotatable Bonds:   2 TPSA:   40.54

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Replicase polyprotein 1ab P0C6X7 (R1AB_SARS) Severe acute respiratory syndrome coronavirus (SARS-CoV) 2VJ1 XP1 IC50 : 5000 nM PDBBind SHOW
Replicase polyprotein 1ab P0C6X7 (R1AB_SARS) Severe acute respiratory syndrome coronavirus (SARS-CoV) 2V6N XP1 Ki : 1380 nM PDBBind SHOW