MCULE-6843796191
- 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 | 34 USD | N/A | 9 working days | Get Quote |
5 mg | 34 USD | N/A | 9 working days | Get Quote |
10 mg | 34 USD | N/A | 9 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-6843796191.sdf |
SMILES | MCULE-6843796191.smiles |
Standard InChI | MCULE-6843796191.inchi |
InChIKey | MCULE-6843796191.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867594965 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
P-875753927 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869292029 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-903087449 | Aaron Chemicals LLC | Predominantly Building Block | 97 | As is | 7 g |
P-893543561 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 9 g |
P-851944732 | AmBeed | In stock | N/A | As is | in stock |
P-489118017 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-619152525 | Angene | Building Blocks in stock | 97 | As is | 7 g |
P-872726315 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
P-895927688 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
P-864174890 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-901468866 | Biosynth | Synthesis | 95 | As is | by synthesis |
P-851242526 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-861379125 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-868658930 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
P-580410297 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-901408302 | FluoroChem | General BB | N/A | As is | in stock |
P-870661546 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
P-855915310 | Key Organics | Building Blocks | 97 | As is | 5 mg |
P-852520823 | Matrix Scientific | All | N/A | As is | in stock |
P-854719784 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
P-871066779 | MedKoo | In stock compounds | 95 | As is | in stock |
P-878642961 | Molnova | Stock | 98 | As is | in stock |
P-491319151 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-869127619 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
P-892291503 | TargetMol | In Stock BB | 95 | As is | unavailable |
P-888640644 | TargetMol | Screening Compounds - stock amount | 95 | As is | 150 mg |
P-667017430 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 364.398 |
logP | 4.73628 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 5 |
PSA | 70.71 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 107.9292 |
Atoms | 44 |
Rings | 4 |
Heavy atoms | 28 |
Hydrogen atoms | 16 |
Heteroatoms | 5 |
N/O atoms | 5 |
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 |