BioLiP

PDB

BioLiP

PDB CCD ID:

CVG

Number of entries in BioLiP:

Chemical formula:

C5 H6 N2 O

InChI:

InChI=1S/C5H6N2O/c1-4-2-3-5(8)7-6-4/h2-3H,1H3,(H,7,8)

InChIKey:

QZWIXLPWMGHDDD-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.6	Cc1ccc(nn1)O
CACTVS 3.385	Cc1ccc(O)nn1
ACDLabs 12.01	c1cc(O)nnc1C

Name:

6-methylpyridazin-3-ol

ZINC:

ZINC000008603112

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).