SEQ2FUN

BioLiP

PDB CCD ID: 4AL
Number of entries in BioLiP: 1
Chemical formula: C8 H11 N O
InChI: InChI=1S/C8H11NO/c9-5-7-1-3-8(6-10)4-2-7/h1-4,10H,5-6,9H2
InChIKey: WMOUKOAUAFESMR-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.352NCc1ccc(CO)cc1
OpenEye OEToolkits 1.7.0c1cc(ccc1CN)CO
Name:[4-(aminomethyl)phenyl]methanol
ChEMBL: CHEMBL1230249
ZINC: ZINC000016696872
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).