MCULE-2854428206-0
- 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 | 5 USD | 95 | 14 working days | Get Quote |
5 mg | 5 USD | 95 | 14 working days | Get Quote |
10 mg | 5 USD | 95 | 14 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.
Name | File |
---|---|
SDF | MCULE-2854428206-0.sdf |
SMILES | MCULE-2854428206-0.smiles |
Standard InChI | MCULE-2854428206-0.inchi |
InChIKey | MCULE-2854428206-0.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867637998 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875803715 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869336937 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-606835940 | AmBeed | In stock | N/A | As is | in stock |
P-851929295 | AmBeed | In stock | N/A | As is | in stock |
P-489229251 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-597004221 | Angene | Building Blocks in stock | 98 | As is | 266 g |
P-589658950 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864148924 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-481173238 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 10 g |
P-590790435 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-851275810 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-861280993 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
P-868561291 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-862082760 | FluoroChem | General BB | 97 | As is | in stock |
P-454318378 | Key Organics | Screening Compounds and Fragments | 90 | As is | unavailable |
P-856076377 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
P-852484132 | Matrix Scientific | All | N/A | As is | in stock |
P-854749507 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
P-889864582 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-596784209 | Synthonix | In-stock Building Blocks | 95 | As is | 535 g |
P-611428144 | Toronto Research | In stock | 90 | As is | in stock |
P-893994477 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 147.173 |
logP | 1.87528 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 1 |
PSA | 33.02 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 42.615 |
Atoms | 20 |
Rings | 1 |
Heavy atoms | 11 |
Hydrogen atoms | 9 |
Heteroatoms | 2 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |