Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5600652235
Compound
Show structure
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 | 37 USD | 98 | 22 working days | Get Quote |
| 5 mg | 73 USD | 98 | 16 working days | Get Quote |
| 10 mg | 120 USD | 98 | 16 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-6866742079
- Component type: Main
-
1
MCULE-9976402631
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-5600652235.sdf |
| SMILES | MCULE-5600652235.smiles |
| Standard InChI | MCULE-5600652235.inchi |
| InChIKey | MCULE-5600652235.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-500255334 | Diverchim | Diverchim General Catalog | N/A | As is | in stock |
| P-867616640 | A2B Chem | Predominantly Building Block in stock | 98 | Main component | in stock |
| P-875777925 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-869224290 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-610965940 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 5.553 g |
| P-606931091 | AmBeed | In stock | N/A | Main component | in stock |
| P-865915918 | Angene | Building Blocks in stock | 97 | Main component | 750 mg |
| P-872725745 | Apexbio Technology | Bioactive Compound Library | 98 | Main component | in stock |
| P-864150162 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-590632842 | BLD pharm | In-stock building blocks | 98 | Main component | unavailable |
| P-851297321 | Chemshuttle | On request catalog | 95 | Main component | by synthesis |
| P-861286632 | Chiralstar | Chiralstar Building Blocks | 98 | Main component | in stock |
| P-861362274 | Combi-Blocks | Building Block on demand | 95 | Main component | by synthesis |
| P-579481103 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| P-854714722 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-584614004 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-608270698 | Molnova | Stock | 98 | Main component | in stock |
| P-889882058 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-579712690 | Selleckchem | Product Catalog | N/A | Main component | in stock |
| P-869162422 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892297541 | TargetMol | In Stock BB | 95 | Main component | unavailable |
| P-888657787 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 85 mg |
| P-868534788 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-611505847 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 783.815 |
| logP | 7.1011 |
| H-bond acceptors | 11 |
| H-bond donors | 3 |
| Rotatable bonds | 12 |
| PSA | 201.67 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 200.4403 |
| Atoms | 87 |
| Rings | 6 |
| Heavy atoms | 54 |
| Hydrogen atoms | 33 |
| Heteroatoms | 17 |
| N/O atoms | 11 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
