SEQ2FUN

BioLiP

PDB CCD ID: WD5
Number of entries in BioLiP: 8
Chemical formula: C11 H14 Cl N O
InChI: InChI=1S/C11H14ClNO/c12-10-3-1-9(2-4-10)11(14)5-7-13-8-6-11/h1-4,13-14H,5-8H2
InChIKey: LZAYOZUFUAMFLD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(ccc1C2(CCNCC2)O)Cl
CACTVS 3.385OC1(CCNCC1)c2ccc(Cl)cc2
Name:4-(4-chlorophenyl)piperidin-4-ol

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).