SEQ2FUN

BioLiP

PDB CCD ID: XLV
Number of entries in BioLiP: 1
Chemical formula: C5 H8 N2 O
InChI: InChI=1S/C5H8N2O/c1-3-4(2)7-8-5(3)6/h6H2,1-2H3
InChIKey: PYNDWPFZDQONDV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7Cc1c(noc1N)C
CACTVS 3.385Cc1noc(N)c1C
ACDLabs 12.01n1oc(N)c(C)c1C
Name:3,4-dimethyl-1,2-oxazol-5-amine
ChEMBL: CHEMBL4760618
ZINC: ZINC000000164496
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).