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Compound Detail

CHEMBL307739

IBOPAMINE
🧪 Phase II
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🧪 Phase II
CNCCc1ccc(OC(=O)C(C)C)c(OC(=O)C(C)C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL307739
Name IBOPAMINE
Phase Phase II
Structure Type MOL
InChI Key WDKXLLJDNUBYCY-UHFFFAOYSA-N

Known Names

Ibopamina Ibopamine SB 7505
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
3
Known Names
1
Indications

Molecular Properties

307.4
MW (Da)
2.57
ALogP
5
HBA
1
HBD
64.6
PSA (Ų)
0.62
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -pamine
USAN Year 1981

Extended Properties

Molecular Formula C17H25NO4
MW 307.39
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness 0.26

Indications

Cardiovascular Diseases

ATC Classification

C01CA16
ibopamine
Level 1: CARDIOVASCULAR SYSTEM
Level 2: CARDIAC THERAPY
S01FB03
ibopamine
Level 1: SENSORY ORGANS
Level 2: OPHTHALMOLOGICALS

Literature References

PubMed DOI Target Context # Activities
37468498 10.1038/s41467-023-40064-9 D(1A) dopamine receptor 3
37468498 10.1038/s41467-023-40064-9 Nuclear receptor subfamily 1 group I member 2 3
37468498 10.1038/s41467-023-40064-9 Cannabinoid receptor 1 2
37468498 10.1038/s41467-023-40064-9 Progesterone receptor 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
37468498 10.1038/s41467-023-40064-9 Beta-1 adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 Muscarinic acetylcholine receptor M2 2
37468498 10.1038/s41467-023-40064-9 Androgen receptor 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2B 2
37468498 10.1038/s41467-023-40064-9 Alpha-1A adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 Beta-2 adrenergic receptor 2
37468498 10.1038/s41467-023-40064-9 Gamma-aminobutyric acid receptor subunit alpha-1 2
37468498 10.1038/s41467-023-40064-9 Gamma-aminobutyric acid receptor subunit alpha-1/alpha-2/beta-2/gamma-2 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 2A 2
37468498 10.1038/s41467-023-40064-9 5-hydroxytryptamine receptor 1A 2
20185316 10.1016/j.bmc.2010.01.068 Plasmodium falciparum 1
20185316 10.1016/j.bmc.2010.01.068 Leishmania mexicana 1
20185316 10.1016/j.bmc.2010.01.068 NON-PROTEIN TARGET 1
20185316 10.1016/j.bmc.2010.01.068 Trypanosoma brucei brucei 1
20185316 10.1016/j.bmc.2010.01.068 Trypanosoma brucei rhodesiense 1

Data from ChEMBL 36 via Core Engine