BioLiP

PDB

BioLiP

PDB CCD ID:

HRG

Number of entries in BioLiP:

Chemical formula:

C7 H16 N4 O2

InChI:

InChI=1S/C7H16N4O2/c8-5(6(12)13)3-1-2-4-11-7(9)10/h5H,1-4,8H2,(H,12,13)(H4,9,10,11)/t5-/m0/s1

InChIKey:

QUOGESRFPZDMMT-YFKPBYRVSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(CCNC(=N)N)CC(C(=O)O)N
OpenEye OEToolkits 1.5.0	C(CCNC(=N)N)C[C@@H](C(=O)O)N
CACTVS 3.341	N[CH](CCCCNC(N)=N)C(O)=O
ACDLabs 10.04	O=C(O)C(N)CCCCNC(=[N@H])N
CACTVS 3.341	N[C@@H](CCCCNC(N)=N)C(O)=O

Name:

L-HOMOARGININE

ChEMBL:

CHEMBL589752

DrugBank:

DB03974

ZINC:

ZINC000001529320

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).