Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-5602916309-0
Structure
Show compound
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 97 | 20 working days | Get Quote |
| 5 mg | 5 USD | 97 | 20 working days | Get Quote |
| 10 mg | 5 USD | 97 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-3226089160-0
- Component type: Main
-
1
MCULE-3743781291-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5602916309-0.sdf |
| SMILES | MCULE-5602916309-0.smiles |
| Standard InChI | MCULE-5602916309-0.inchi |
| InChIKey | MCULE-5602916309-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869151355 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888650847 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-867560945 | A2B Chem | Predominantly Building Block in stock | 95 | Main component | in stock |
| P-875721644 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-535625985 | AK Scientific | Building Blocks | 97 | Main component | in stock |
| P-505351323 | AK Scientific | Building Blocks | 99 | Main component | in stock |
| P-893338208 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component | by synthesis |
| P-868819575 | AmBeed | In stock | N/A | Main component | in stock |
| P-596927800 | Angene | Building Blocks in stock | 97 | Main component | 3 kg |
| P-896040618 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-864147746 | AstaTech | In Stock BBs | 99 | Main component | in stock |
| P-893232533 | Biosynth | In Stock | 95 | Main component | in stock |
| P-893232554 | Biosynth | In Stock | 95 | Main component | in stock |
| P-505496168 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component | in stock |
| P-492242519 | Innovapharm | Building Blocks | 95 | Main component | in stock |
| P-613276594 | Life Chemicals | Building Blocks - virtual | 95 | Main component | by synthesis |
| P-892238534 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892292911 | TargetMol | In Stock BB | 95 | Main component | 1.003 g |
| P-892328397 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 1.003 g |
| P-611350873 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893980251 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-666969762 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-893146930 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-892939956 | A2B Chem | Predominantly Building Block on demand | N/A | Main component as a main component | by synthesis |
| P-867587377 | A2B Chem | Predominantly Building Block in stock | 96 | Main component as a main component | in stock |
| P-867587379 | A2B Chem | Predominantly Building Block in stock | 98 | Main component as a main component | in stock |
| P-889897530 | AA Blocks | AA Blocks - synthesis | N/A | Main component as a main component | by synthesis |
| P-875746381 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875746383 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-875830963 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-869185257 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-869182272 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-869190371 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-505351334 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-505353600 | AK Scientific | Building Blocks | N/A | Main component as a main component | in stock |
| P-588246409 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-615723386 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-580232213 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component as a main component | by synthesis |
| P-580232214 | Aldlab Chemicals | Building Block Custom Synth | 95 | Main component as a main component | by synthesis |
| P-606864905 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-606874675 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-851151708 | Angene | Building Blocks in stock | 98 | Main component as a main component | 4 kg |
| P-900248030 | Angene | Building Blocks in stock | N/A | Main component as a main component | 3.5 kg |
| P-596954863 | Angene | Building Blocks in stock | 96 | Main component as a main component | 9 kg |
| P-596954865 | Angene | Building Blocks in stock | 98 | Main component as a main component | 7 kg |
| P-864114978 | AstaTech | In Stock BBs | 97 | Main component as a main component | in stock |
| P-864142547 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864184043 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-864184879 | AstaTech | In Stock BBs | 95 | Main component as a main component | in stock |
| P-893232663 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-580426772 | Debye Scientific | General Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-580426773 | Debye Scientific | General Catalog | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-505538141 | Hangzhou Apichem | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-874465975 | Life Chemicals | Building Blocks - virtual | 95 | Main component as a main component | by synthesis |
| P-892262492 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892302961 | TargetMol | Natural Products | 95 | Main component as a main component | in stock |
| P-892250832 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892274654 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-869144012 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-869150744 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-869178463 | TargetMol | Natural Products | 95 | Main component as a main component | in stock |
| P-892343873 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| P-888650623 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| P-892336293 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| P-888647925 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | unavailable |
| P-892299461 | TargetMol | In Stock BB | 95 | Main component as a main component | 1.004 g |
| P-892351058 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | 1.004 g |
| P-873223338 | TimTec | Building Block Collection | 90 | Main component as a main component | in stock |
| P-611404556 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-611350876 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-611350877 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-893996286 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| P-480893370 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 208.213 |
| logP | 1.1503 |
| H-bond acceptors | 7 |
| H-bond donors | 5 |
| Rotatable bonds | 5 |
| PSA | 146.87 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 48.7962 |
| Atoms | 30 |
| Rings | 0 |
| Heavy atoms | 14 |
| Hydrogen atoms | 16 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
