SEQ2FUN

BioLiP

PDB CCD ID: 8V8
Number of entries in BioLiP: 2
Chemical formula: C10 H10 N2 O3 S
InChI: InChI=1S/C10H10N2O3S/c1-7-12-6-10(15-7)8-2-4-9(5-3-8)16(11,13)14/h2-6H,1H3,(H2,11,13,14)
InChIKey: FETRXICILYMBJH-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385Cc1oc(cn1)c2ccc(cc2)[S](N)(=O)=O
OpenEye OEToolkits 2.0.6Cc1ncc(o1)c2ccc(cc2)S(=O)(=O)N
Name:4-(2-methyl-1,3-oxazol-5-yl)benzenesulfonamide
ChEMBL: CHEMBL3608870
ZINC: ZINC000230549273
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).