Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9563424399
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 | 39 USD | 95 | 9 working days | Get Quote |
| 5 mg | 47 USD | 95 | 9 working days | Get Quote |
| 10 mg | 68 USD | 95 | 9 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.
| Name | File |
|---|---|
| SDF | MCULE-9563424399.sdf |
| SMILES | MCULE-9563424399.smiles |
| Standard InChI | MCULE-9563424399.inchi |
| InChIKey | MCULE-9563424399.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867557174 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875716211 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-892793786 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-610975034 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2.7 g |
| P-870135982 | AmBeed | In stock | N/A | As is | in stock |
| P-900243595 | Angene | Building Blocks in stock | 98 | As is | 400 mg |
| P-889563026 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-872717269 | BLD pharm | In-stock building blocks | 98 | As is | unavailable |
| P-878235669 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-887183522 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-579480847 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-873245360 | Key Organics | Building Blocks | 97 | As is | 5 mg |
| P-854717152 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474023100 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-878640849 | Molnova | Stock | 98 | As is | in stock |
| P-617403825 | Selleckchem | Product Catalog | N/A | As is | in stock |
| P-869156996 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892293662 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888653164 | TargetMol | Screening Compounds - stock amount | 95 | As is | 50 mg |
| P-611481158 | Toronto Research | In stock | 90 | As is | in stock |
| P-611471079 | Toronto Research | In stock | 90 | As is | in stock |
| P-886952118 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 374.231 |
| logP | 4.1774 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 47.48 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 94.667 |
| Atoms | 39 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 16 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
