BioLiP

PDB

BioLiP

PDB CCD ID:

DS1

Number of entries in BioLiP:

Chemical formula:

C4 H5 N3 O

InChI:

InChI=1S/C4H5N3O/c5-4-6-1-3(8)2-7-4/h1-2,8H,(H2,5,6,7)

InChIKey:

NVYMOVCPYONOSF-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	Nc1ncc(O)cn1
ACDLabs 12.01	c1c(O)cnc(n1)N
OpenEye OEToolkits 2.0.6	c1c(cnc(n1)N)O

Name:

2-aminopyrimidin-5-ol

ZINC:

ZINC000021298001

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).