GRL-0617

CHEBI:167176 ·resolve ·ANTIVIRAL ·EXACT SEEDED

A benzamide resulting from the formal condensation of the carboxy group of 5-amino-2-methylbenzoic acid with the amino group of (1R)-1-(naphthalen-1-yl)ethan-1-amine. It is a potent noncovalent inhibitor (IC50 = 600 nM) of severe acute respiratory syndrome-coronavirus papain-like protease (SARS-CoV PLpro). — ChEBI

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:140325 CHEBI:140325
CHEBI:22702 CHEBI:22702
CHEBI:25477 CHEBI:25477
CHEBI:48975 CHEBI:48975

Chemical structure

Computed structure properties
Molecular formula	C20H20N2O
Charge	0
Average mass	304.393 Da
Monoisotopic mass	304.15756 Da
Source	ChEBI
InChIKey	UVERBUNNCOKGNZ-CQSZACIVSA-N

SMILES

Cc1ccc(N)cc1C(=O)N[C@H](C)c1cccc2ccccc12

InChI

InChI=1S/C20H20N2O/c1-13-10-11-16(21)12-19(13)20(23)22-14(2)17-9-5-7-15-6-3-4-8-18(15)17/h3-12,14H,21H2,1-2H3,(H,22,23)/t14-/m1/s1

Also called

5-amino-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide (EXACT_SYNONYM)— chebi
5-amino-2-methyl-N-[(1R)-1-(1-naphthalenyl)ethyl]benzamide (EXACT_SYNONYM)— chebi
5-amino-2-methyl-N-[(R)-1-(1-naphthyl)ethyl]benzamide (EXACT_SYNONYM)— chebi
GRL 0617 (EXACT_SYNONYM)— chebi
GRL0617 (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:1093070-16-6
pdb-ccd:TTT

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:149553 CHEBI:149553

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:167176`	GRL-0617	`antibioticmech:chebi-c97057ae5c`	2026-08-30

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.