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Compound Detail

CHEMBL455917

CHLORAL HYDRATE
🧪 Phase III
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🧪 Phase III
OC(O)C(Cl)(Cl)Cl

Basic Information

ChEMBL ID CHEMBL455917
Name CHLORAL HYDRATE
Phase Phase III
Structure Type MOL
InChI Key RNFNDJAIBTYOQL-UHFFFAOYSA-N
Therapeutic ✓ Yes

Known Names

Chloral hydrate Chlorali hydras Chloralum Cloral hydrate Noctec NSC-3210
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
6
Known Names
5
Indications
1
Mechanisms

Molecular Properties

165.4
MW (Da)
0.67
ALogP
2
HBA
2
HBD
40.5
PSA (Ų)
0.41
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product

Extended Properties

Molecular Formula C2H3Cl3O2
MW 165.40
Aromatic Rings 0
Heavy Atoms 7
NP-Likeness 0.06

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
Unknown - -

Indications

Anxiety Brain Diseases Dementia Depressive Disorder Schizophrenia

ATC Classification

N05CC01
chloral hydrate
Level 1: NERVOUS SYSTEM
Level 2: PSYCHOLEPTICS

Literature References

PubMed DOI Target Context # Activities
20014752 10.1021/tx900326k Hepatotoxicity 3
18834112 10.1021/jm800656v Amine oxidase [flavin-containing] A 1
28197313 10.1021/acsmedchemlett.6b00417 Myeloperoxidase 1

Data from ChEMBL 36 via Core Engine