Drug Details

Name:

AC1MVQ8O

PubChem ID:

3687256

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C31H36N2O4/c1-20(2)25-11-10-21(3)16-28(25)37-19-24(34)18-32-14-12-22(13-15-32)17-33-30(35)26-8-4-6-23-7-5-9-27(29(23)26)31(33)36/h4-11,16,20,22,24,34H,12-15,17-19H2,1-3H3

SMILES:

OC(CN1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)COc1cc(C)ccc1C(C)C

Properties:

Formula:	C31H36N2O4	Atoms:	37
Molecular Weight:	500.629	Rotatable Bonds:	8
H-bond Acceptors:	6	H-bond Donors:	1
logP:	4.4743

Targets:

Name	Uniprot ID	Source	References	Interaction
Beta-1 adrenergic receptor	ADRB1_HUMAN	BindingDB	-	shows
Beta-3 adrenergic receptor	ADRB3_HUMAN	BindingDB	-	shows

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Synonyms:

2-[[1-[2-hydroxy-3-(5-methyl-2-propan-2-ylphenoxy)propyl]piperidin-4-yl]me

AC1MVQ8O

AKOS001634727

CHEBI:730490

CHEMBL1083994

CID 3687256

CID3687256

MolPort-004-879-514

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