SEQ2FUN

BioLiP

PDB CCD ID: 1DH
Number of entries in BioLiP: 2
Chemical formula: C3 H3 Cl N2 S
InChI: InChI=1S/C3H3ClN2S/c4-2-1-6-3(5)7-2/h1H,(H2,5,6)
InChIKey: SWQWTDAWUSBMGA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370Nc1sc(Cl)cn1
OpenEye OEToolkits 1.7.6c1c(sc(n1)N)Cl
ACDLabs 12.01Clc1sc(nc1)N
Name:5-chloro-1,3-thiazol-2-amine
ChEMBL: CHEMBL2323848
ZINC: ZINC000017354929
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).