SEQ2FUN

BioLiP

PDB CCD ID: BHA
Number of entries in BioLiP: 5
Chemical formula: C7 H7 N O3
InChI: InChI=1S/C7H7NO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,8H2,(H,10,11)
InChIKey: WUBBRNOQWQTFEX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1cc(c(cc1N)O)C(=O)O
ACDLabs 10.04O=C(O)c1ccc(cc1O)N
CACTVS 3.341Nc1ccc(C(O)=O)c(O)c1
Name:2-HYDROXY-4-AMINOBENZOIC ACID
ChEMBL: CHEMBL1169
DrugBank: DB00233
ZINC: ZINC000000000922
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).