BioLiP

PDB

BioLiP

PDB CCD ID:

A1AMZ

Number of entries in BioLiP:

Chemical formula:

C6 H6 N4 O2 S

InChI:

InChI=1S/C6H6N4O2S/c7-13(11,12)6-4-8-5-2-1-3-9-10(5)6/h1-4H,(H2,7,11,12)

InChIKey:

BZFKHPWXOXGGCH-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1cc2ncc(n2nc1)S(=O)(=O)N
CACTVS 3.385	N[S](=O)(=O)c1cnc2cccnn12
ACDLabs 12.01	NS(=O)(=O)c1cnc2cccnn12

Name:

(4R)-imidazo[1,2-b]pyridazine-3-sulfonamide

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).