ZINC4629876 (Daral)

In:
Added Available Since Mwt logP Heavy Atoms Tranche Download
2005-12-15 In-Stock 2015-08-07 396.659 7.641 29 GKEA
ZINC4629876
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Available 3D Representations

pH range Net
charge		 H-bond
donors		 H-bond
acceptors		 tPSA Ų Rotatable
bonds		 Apolar
desolvationkcal/mol		 Polar
desolvationkcal/mol		 Download
Reference 0 1 1 20 5 14.03 -2.26
45 Items Total

Vendors (30 Total)

Molport
Selleck Chemicals
Bioactive Toronto Research Chemicals
Building Blocks Sigma Aldrich (Building Blocks)
APExBIO
  • A3912
Bosche Scientific
  • V0016
Capot Chemical
Bioactive Cayman Chemical
Chemaphor
Chem-Impex International
  • 1529
Fluorochem
Hangzhou Yuhao Chemical Technology
  • HL1057
IBScreen NP
Building Blocks AbovChem
  • HY-76542
Building Blocks Acros Organics
Building Blocks AK Scientific
Building Blocks AstaTech
Building Blocks BioSynth
Building Blocks BOC Sciences BB
Building Blocks Boerchem Pharmatech BB
Building Blocks EndoTherm
Building Blocks FineTech
Building Blocks Tetrahedron Building Blocks
Building Blocks W&J PharmaChem
  • 50A119230
Ambinter
eMolecules
Building Blocks Ark Pharm BB Make-on-demand
Building Blocks eMolecules Building Blocks
Building Blocks Lab Network Building Blocks
  • LN01326436
Building Blocks Molcore
40 Items Total

Annotated Catalogs (33 Total)

In Man MicroSource Pharmakon
  • 01500276
Bioactive MicroSource Spectrum
  • 01500276
In Man MicroSource US Drugs
  • 01500276
MLSMR
Bioactive SMDC Pharmakon
Bioactive Bovine Metabolome
Bioactive ChEBI
ChEMBL20
ChEMBL 21
ChEMBL23
In Man ChEMBL DrugStore
Bioactive DrugBank All
World Drugs DrugBank-approved
FDA Approved Drugs DrugBank FDA only
World Drugs DrugBank-nutriceuticals
FDA-approved drugs (via DSSTOX)
In Man Food Database
In Man HMDB Drug
Endogenous Human Metabolites Metabolites Bioactive HMDB Endogenous
In Man HMDB Food
In Man Human Metabolome Database
Bioactive KEGG-C via PubChem
In Man KEGG-D via PubChem
Bioactive KEGG via PubChem
Lipidomics
Bioactive PDSP via PubChem
  • Prestwick_554
Bioactive Protein Databank
  • D2V
In Man Serum Metabolome
Bioactive SMDC MicroSource
SMDC Public
Sweetlead
  • SW02952
UNPD
  • UNPD194571
In Man Urine Metabolome

Activities based on ChEMBL 20

Run SEA

SEA Predictions based on ChEMBL 20

Gene Description Target Class P-Value Max Tc
GC Vitamin D-binding protein Secreted / secreted 0 49
VDRA Vitamin D3 receptor A Transcription factor / NR 0 49
CYP27B1 25-hydroxyvitamin D-1 alpha hydroxylase, mitochondrial enzyme / enzyme-other 26 45
CYP24A1 1,25-dihydroxyvitamin D(3) 24-hydroxylase, mitochondrial enzyme / p450 44 58
VDR Vitamin D3 receptor Transcription factor / NR 129 53
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Interesting Analogs

Scaffold of this compound

ZINC4629876

ZINC4629876

5294781 ZINC5294781

Sources of Ambiguity Find More

Substance Rings

1,2-dimethylenecyclohexane
7-methylene-1,2,3,3a,4,5,6,7a-octahydroindene

Molecular Patterns (Warnings, etc.)

alkene-terminal-sp2
Functional group
alkene-terminal-sp3
Functional group
alcohol-secondary
reagent
alkene-internal-sp2
reagent

References

This substance is not reported in any publications per ChEMBL.

View All 251 Clinical Trials

Trial ID Title Status Phase Start Date Condition(s) Drug(s)
NCT00006196 The Relationship Between Vitamin D, Fingernail Thickness and Bone Density Completed Phase 1 Unknown
Osteoporosis
Vitamin D
NCT02400151 Vascular and Metabolic Effects of Vitamin D Supplementation Associated With Lifestyle Management in Obese Adolescents Not yet recruiting Phase 4 Mar 2016
Obesity
Normal control
Vitamin D supplementation
Placebo
3 months lifestyle and dietary management
NCT02256215 Vitamin D in the Treatment of Primary Restless Legs Syndrome Not yet recruiting Phase 2/Phase 3 Dec 2015
Restless Legs Syndrome
Vitamin D
NCT02276755 Vitamin D Suplementation in TB Prevention Not yet recruiting Phase 3 Sep 2015
Latent Tuberculosis
cholecalciferol (vitamin D)
Placebo
NCT02338934 Cinacalcet in Management of Secondary Hyperparathyroidism in Haemodialysis Patients Not yet recruiting Phase 4 Jan 2015
Secondary Hyperparathyroidism
Combination Cinacalcet with Vitamin D analogue

Additional Identifiers (Synonyms/CAS Numbers/etc.)

CAS Numbers
ATC Code(s)
WHO Name(s)
Molecule Names
  • ERGOCALCIFEROL
Synonyms

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