BioLiP

PDB

BioLiP

PDB CCD ID:

EAB

Number of entries in BioLiP:

Chemical formula:

C15 H15 N3 O2

InChI:

InChI=1S/C15H15N3O2/c16-10-12-4-2-6-14(8-12)18-17-13-5-1-3-11(7-13)9-15(19)20/h1-8H,9-10,16H2,(H,19,20)/b18-17+

InChIKey:

RHNJRPYVLIXHAK-ISLYRVAYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	c1cc(cc(c1)N=Nc2cccc(c2)CN)CC(=O)O
OpenEye OEToolkits 1.5.0	c1cc(cc(c1)/N=N/c2cccc(c2)CN)CC(=O)O
CACTVS 3.341	NCc1cccc(c1)N=Nc2cccc(CC(O)=O)c2
ACDLabs 10.04	O=C(O)Cc2cccc(/N=N/c1cccc(c1)CN)c2

Name:

(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID

ZINC:

ZINC000058633461

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).