SEQ2FUN

BioLiP

PDB CCD ID: 1LD
Number of entries in BioLiP: 6
Chemical formula: C4 H4 F N3 O
InChI: InChI=1S/C4H4FN3O/c5-2-1-7-4(9)8-3(2)6/h1H,(H3,6,7,8,9)
InChIKey: XRECTZIEBJDKEO-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6C1=C(C(=NC(=O)N1)N)F
CACTVS 3.370NC1=NC(=O)NC=C1F
ACDLabs 12.01FC1=CNC(=O)N=C1N
Name:5-fluorocytosine;
4-amino-5-fluoropyrimidin-2(1H)-one
ChEMBL: CHEMBL1463
DrugBank: DB01099
ZINC: ZINC000000896546
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).