SEQ2FUN

BioLiP

PDB CCD ID: LR8
Number of entries in BioLiP: 1
Chemical formula: C10 H13 N3 O2
InChI: InChI=1S/C10H13N3O2/c11-10(14)8-1-2-9(12-7-8)13-3-5-15-6-4-13/h1-2,7H,3-6H2,(H2,11,14)
InChIKey: WGUWZMKBMLBNEE-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(ncc1C(=O)N)N2CCOCC2
CACTVS 3.385NC(=O)c1ccc(nc1)N2CCOCC2
Name:6-morpholin-4-ylpyridine-3-carboxamide
ChEMBL: CHEMBL1720183
ZINC: ZINC000019932164
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).