MCULE-6315536472
- 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 | 36 USD | 90 | 21 working days | Get Quote |
5 mg | 36 USD | 97 | 16 working days | Get Quote |
10 mg | 36 USD | 97 | 16 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-6315536472.sdf |
SMILES | MCULE-6315536472.smiles |
Standard InChI | MCULE-6315536472.inchi |
InChIKey | MCULE-6315536472.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867629872 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
P-875793754 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-590418103 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-867708069 | AmBeed | In stock | N/A | As is | in stock |
P-489218686 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-865919436 | Angene | Building Blocks in stock | 97 | As is | 20 g |
P-494352023 | Apollo Scientific | In Stock | 95 | As is | in stock |
P-864123426 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-861315816 | BLD pharm | In-stock building blocks | 97 | As is | 1000 mg |
P-619931923 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
P-505604296 | Chemcia | Virtual compounds | 97 | As is | by synthesis |
P-851261853 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
P-861279458 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
P-868597402 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
P-881677925 | EDASA Scientific Limited | Synthesis Building Blocks | N/A | As is | by resynthesis (? - ? days) |
P-862032361 | FluoroChem | General BB | N/A | As is | in stock |
P-890222544 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
P-869097683 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
P-502571024 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-454385017 | Key Organics | Building Blocks | 95 | As is | 20.636 g |
P-18811114 | Key Organics | Screening Compounds and Fragments | 95 | As is | 20.636 g |
P-873390005 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
P-860794373 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852424600 | Matrix Scientific | All | N/A | As is | in stock |
P-888905919 | PharmaBlock | In stock | N/A | As is | in stock |
P-579707492 | Sinova Inc. | In-stock Building Blocks | N/A | As is | in stock |
P-502403174 | TimTec | Building Block Collection | 90 | As is | in stock |
P-611608683 | Toronto Research | In stock | 90 | As is | in stock |
P-886932789 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 225.287 |
logP | 1.87658 |
H-bond acceptors | 5 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 79.35 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 63.8944 |
Atoms | 35 |
Rings | 1 |
Heavy atoms | 16 |
Hydrogen atoms | 19 |
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 |