SEQ2FUN

BioLiP

PDB CCD ID: I8M
Number of entries in BioLiP: 4
Chemical formula: C11 H15 N O2
InChI: InChI=1S/C11H15NO2/c13-11-4-2-1-3-10(11)9-12-5-7-14-8-6-12/h1-4,13H,5-9H2
InChIKey: OYLIEVIKIUHKTG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01Oc1ccccc1CN1CCOCC1
CACTVS 3.385Oc1ccccc1CN2CCOCC2
OpenEye OEToolkits 2.0.7c1ccc(c(c1)CN2CCOCC2)O
Name:2-[(morpholin-4-yl)methyl]phenol
ChEMBL: CHEMBL5197011
ZINC: ZINC000021953114
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).