MCULE-6774095524-0
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
![]() Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
![]() Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
---|---|---|---|---|
1 mg | 50 USD | 90 | 21 working days | Get Quote |
5 mg | 72 USD | 95 | 21 working days | Get Quote |
10 mg | 72 USD | 95 | 21 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
1
MCULE-9940000830-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-6774095524-0.sdf |
SMILES | MCULE-6774095524-0.smiles |
Standard InChI | MCULE-6774095524-0.inchi |
InChIKey | MCULE-6774095524-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886689110 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-889990497 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
P-869210582 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-903256417 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 2.5 g |
P-851723819 | AmBeed | On request | N/A | As is | by synthesis |
P-889808588 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-611134752 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
P-901540480 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-861389882 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-854875693 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-611409069 | Toronto Research | In stock | 90 | As is | in stock |
P-893731428 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
P-892979709 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
P-890152312 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
P-894662068 | AK Scientific | Building Blocks | 95 | Main component | in stock |
P-893580821 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 14.791 g |
P-888932569 | AmBeed | On request | N/A | Main component | by synthesis |
P-895943131 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
P-905464509 | AstaTech | In Stock BBs | 95 | Main component | in stock |
P-905588039 | BLD pharm | Non-stock building blocks | 98 | Main component | by synthesis |
P-889351939 | FluoroChem | China Stock BB | 98 | Main component | 6.891 g |
P-905357275 | FluoroChem | German Stock BB | 98 | Main component | 100 mg |
P-492222830 | Innovapharm | Building Blocks | 95 | Main component | in stock |
P-872527350 | MedChemExpress | Building Blocks in stock | 95 | Main component | in stock |
P-492284563 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | Main component | 13.998 g |
P-12911527 | Otava | In-House Stock Library | 90 | Main component | 13.998 g |
P-888879133 | PharmaBlock | In stock | N/A | Main component | in stock |
P-33909469 | TimTec | ActiMol 6 Week | 90 | Main component | in stock |
P-502339136 | TimTec | Building Block Collection | 90 | Main component | in stock |
P-611409068 | Toronto Research | In stock | 90 | Main component | in stock |
Property | Value |
---|---|
Components | 2 |
Mass | 229.744 |
logP | 3.8239 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 35.25 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 66.6834 |
Atoms | 35 |
Rings | 1 |
Heavy atoms | 15 |
Hydrogen atoms | 20 |
Heteroatoms | 3 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |