MCULE-6173393622
- 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 | 16 USD | N/A | 35 working days | Get Quote |
5 mg | 16 USD | N/A | 35 working days | Get Quote |
10 mg | 16 USD | N/A | 35 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-6173393622.sdf |
SMILES | MCULE-6173393622.smiles |
Standard InChI | MCULE-6173393622.inchi |
InChIKey | MCULE-6173393622.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867559734 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
P-875719782 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-869294280 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-893534301 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 342.45 g |
P-851550281 | AmBeed | On request | N/A | As is | by synthesis |
P-489123880 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-619167276 | Angene | Building Blocks in stock | 97 | As is | 75 g |
P-596659715 | Apollo Scientific | In Stock | 95 | As is | in stock |
P-864135290 | AstaTech | In Stock BBs | 95 | As is | in stock |
P-893622702 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-580275203 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
P-675514099 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-675477841 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-563666294 | Key Organics | Building Blocks | 95 | As is | 250 mg |
P-855999888 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
P-580467103 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-854796215 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-492278468 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
P-424074097 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
P-500384529 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
P-872516699 | Ramidus | In stock compounds | 95 | As is | in stock |
P-611582299 | Toronto Research | In stock | 90 | As is | in stock |
P-588725053 | VITAS M CHEMICAL LIMITED | Virtual synthesis library | N/A | As is | by synthesis |
P-893646804 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 184.617 |
logP | 2.6383 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 2 |
PSA | 37.3 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 48.4765 |
Atoms | 21 |
Rings | 1 |
Heavy atoms | 12 |
Hydrogen atoms | 9 |
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 |