BioLiP

PDB

BioLiP

PDB CCD ID:

A1I25

Number of entries in BioLiP:

Chemical formula:

C9 H8 N2 S

InChI:

InChI=1S/C9H8N2S/c10-9-11-8(6-12-9)7-4-2-1-3-5-7/h1-6H,(H2,10,11)

InChIKey:

PYSJLPAOBIGQPK-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc(cc1)c2csc(n2)N
CACTVS 3.385	Nc1scc(n1)c2ccccc2

Name:

4-phenyl-1,3-thiazol-2-amine

ChEMBL:

CHEMBL175296

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).