BioLiP

PDB

BioLiP

PDB CCD ID:

A1EM6

Number of entries in BioLiP:

Chemical formula:

C11 H15 N O

InChI:

InChI=1S/C11H15NO/c13-11(6-8-12-9-7-11)10-4-2-1-3-5-10/h1-5,12-13H,6-9H2

InChIKey:

KQKFQBTWXOGINC-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc(cc1)C2(CCNCC2)O
CACTVS 3.385	OC1(CCNCC1)c2ccccc2

Name:

4-phenylpiperidin-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).