Compound Detail

CHEMBL1927024

(S)-P-HYDROXYAMPHETAMINE

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C[C@H](N)Cc1ccc(O)cc1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL1927024
Name	(S)-P-HYDROXYAMPHETAMINE
Phase	Preclinical
Structure Type	MOL
InChI Key	GIKNHHRFLCDOEU-ZETCQYMHSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

151.2

MW (Da)

1.28

ALogP

HBA

HBD

46.2

PSA (Å²)

0.67

QED

Ro5 Violations

Rot. Bonds

Natural Product First in Class Prodrug

EC50 4 meas. best 7.0

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Trace amine-associated receptor 1 CHEMBL1926495	EC50	7.0	7.0	101.0	1
Trace amine-associated receptor 1 CHEMBL3833	EC50	6.72	6.72	190.0	1
Trace amine-associated receptor 1 CHEMBL4908	EC50	6.55	6.55	280.0	1
Trace amine-associated receptor 1 CHEMBL5857	EC50	5.53	5.53	2960.0	1

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Trace amine-associated receptor 1	EC50	=	101.0	nM	7.0	Activation of rhesus monkey TAAR1 expressed in RD-HGA16 cells co-expressing Gq p...	22037049
Trace amine-associated receptor 1	EC50	=	190.0	nM	6.72	Activation of rat TAAR1 expressed in HEK293 cells assessed as accumulation of [3...	22037049
Trace amine-associated receptor 1	EC50	=	280.0	nM	6.55	Activation of mouse TAAR1 expressed in human HEK293 cells assessed as accumulati...	22037049
Trace amine-associated receptor 1	EC50	=	2960.0	nM	5.53	Activation of C-terminal HA epitope tagged human TAAR1 expressed in RD-HGA16 cel...	22037049

PubMed	DOI	Target Context	# Activities
22037049	10.1016/j.bmc.2011.10.007	Trace amine-associated receptor 1	4
22037049	10.1016/j.bmc.2011.10.007	Unchecked	1
24249037	10.1007/s11095-013-1232-z	No relevant target	1

Data from ChEMBL 36 via Core Engine