BioLiP

PDB

BioLiP

PDB CCD ID:

AAR

Number of entries in BioLiP:

Chemical formula:

C6 H16 N5 O

InChI:

InChI=1S/C6H15N5O/c7-4(5(8)12)2-1-3-11-6(9)10/h4H,1-3,7H2,(H2,8,12)(H4,9,10,11)/p+1/t4-/m0/s1

InChIKey:

ULEBESPCVWBNIF-BYPYZUCNSA-O

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(CC(C(=O)N)N)CNC(=[NH2+])N
CACTVS 3.341	N[C@@H](CCCNC(N)=[NH2+])C(N)=O
ACDLabs 10.04	O=C(N)C(N)CCCN\C(=[NH2+])N
CACTVS 3.341	N[CH](CCCNC(N)=[NH2+])C(N)=O
OpenEye OEToolkits 1.5.0	C(C[C@@H](C(=O)N)N)CNC(=[NH2+])N

Name:

ARGININEAMIDE

DrugBank:

DB02299

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).