EHR

2-[(2-phenylphenyl)amino]benzoic acid

Created:	2019-12-24
Last modified:	2020-04-15

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1 entries where EHR is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	37
Chiral Atom Count	0
Bond Count	39
Aromatic Bond Count	18

2D diagram of EHR

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Chemical Component Summary
Name	2-[(2-phenylphenyl)amino]benzoic acid
Systematic Name (OpenEye OEToolkits)	2-[(2-phenylphenyl)amino]benzoic acid
Formula	C₁₉ H₁₅ N O₂
Molecular Weight	289.328
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OC(=O)c1ccccc1Nc2ccccc2c3ccccc3
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)c2ccccc2Nc3ccccc3C(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)c1ccccc1Nc2ccccc2c3ccccc3
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)c2ccccc2Nc3ccccc3C(=O)O
InChI	InChI	1.03	InChI=1S/C19H15NO2/c21-19(22)16-11-5-7-13-18(16)20-17-12-6-4-10-15(17)14-8-2-1-3-9-14/h1-13,20H,(H,21,22)
InChIKey	InChI	1.03	YKXRPQKGOAZEFQ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	12166386
CCDC/CSD	PEFMIX
COD	4021365

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.