nelutroctiv (CHEBI:759144)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:759144 - nelutroctiv

Default Structure

Take structure to advanced search

ChEBI ID	CHEBI:759144
ChEBI Name	nelutroctiv
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C24H22F5N3O4S
Net Charge	0
Average Mass	543.514
Monoisotopic Mass	543.12512
SMILES	[H][C@@]12C[C@H](C(=O)N[C@@H](c3cc(F)c(C(F)(F)F)cc3F)C3CC3)N(C(=O)c3cncc(S(C)(=O)=O)c3)[C@]1([H])C2
InChI	InChI=1S/C24H22F5N3O4S/c1-37(35,36)14-4-13(9-30-10-14)23(34)32-19-5-12(19)6-20(32)22(33)31-21(11-2-3-11)15-7-18(26)16(8-17(15)25)24(27,28)29/h4,7-12,19-21H,2-3,5-6H2,1H3,(H,31,33)/t12-,19-,20-,21-/m1/s1
InChIKey	BDIJXTIDFAIBQF-OOCUOIDPSA-N

Roles Classification

cardiovascular drug A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.

ChEBI Ontology

Outgoing Relation(s)
	nelutroctiv (CHEBI:759144) has role cardiovascular drug (CHEBI:35554)
	nelutroctiv (CHEBI:759144) is a amino acid amide (CHEBI:22475)

INN	Source
nelutroctiv	WHO MedNet

Synonyms	Source
AMG 594	ChEMBL
AMG-594	ChEMBL
AMG594	ChEMBL
CK-136	ChEMBL
CK-3828136	ChEMBL

Citations