Drug Details

Name:

CHEMBL1081254

PubChem ID:

46880672

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C28H27N3O3/c1-19-18-30(15-16-31(19)28(33)24-8-5-22-13-14-29-26(22)17-24)27(32)23-6-3-20(4-7-23)21-9-11-25(34-2)12-10-21/h3-14,17,19,29H,15-16,18H2,1-2H3/t19-/m0/s1

SMILES:

COc1ccc(cc1)c1ccc(cc1)C(=O)N1CCN([C@H](C1)C)C(=O)c1ccc2c(c1)[nH]cc2

Properties:

Formula:	C28H27N3O3	Atoms:	34
Molecular Weight:	453.532	Rotatable Bonds:	6
H-bond Acceptors:	5	H-bond Donors:	1
logP:	4.706

Targets:

Name	Uniprot ID	Source	References	Interaction
5-hydroxytryptamine receptor 2A	5HT2A_HUMAN	BindingDB	-	shows
5-hydroxytryptamine receptor 2C	5HT2C_HUMAN	BindingDB	-	shows
Alpha-2A adrenergic receptor	ADA2A_HUMAN	BindingDB	-	shows
D(2) dopamine receptor	DRD2_HUMAN	BindingDB	-	shows
D(3) dopamine receptor	DRD3_HUMAN	BindingDB	-	shows
Histamine H2 receptor	HRH2_HUMAN	BindingDB	-	shows
Kappa-type opioid receptor	OPRK_HUMAN	BindingDB	-	shows
Mu-type opioid receptor	OPRM_HUMAN	BindingDB	-	shows
Muscarinic acetylcholine receptor M3	ACM3_HUMAN	BindingDB	-	shows
Sodium-dependent dopamine transporter	SC6A3_HUMAN	BindingDB	-	shows
Sodium-dependent noradrenaline transporter	SC6A2_HUMAN	BindingDB	-	shows
Sodium-dependent serotonin transporter	SC6A4_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:713429

CHEMBL1081254

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