Drug Details

Name:

CHEMBL92965

PubChem ID:

10504148

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C27H25NO4S/c1-19-6-2-3-7-22(19)25(11-12-27(29)30)32-26-16-21(31-17-20-13-15-33-18-20)9-10-23(26)24-8-4-5-14-28-24/h2-10,13-16,18,25H,11-12,17H2,1H3,(H,29,30)

SMILES:

OC(=O)CCC(c1ccccc1C)Oc1cc(OCc2ccsc2)ccc1c1ccccn1

Properties:

Formula:	C27H25NO4S	Atoms:	33
Molecular Weight:	459.557	Rotatable Bonds:	10
H-bond Acceptors:	6	H-bond Donors:	1
logP:	6.6824

Targets:

Name	Uniprot ID	Source	References	Interaction
Endothelin B receptor	EDNRB_RAT	BindingDB	-	shows
Endothelin-1 receptor	EDNRA_RAT	BindingDB	-	shows

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Synonyms:

4-(2-methylphenyl)-4-[2-pyridin-2-yl-5-(thiophen-3-ylmethoxy)phenoxy]butan

CHEBI:249886

CHEMBL92965

CID10504148

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