Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2470000007
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 | 36 USD | 98 | 16 working days | Get Quote |
| 5 mg | 56 USD | 98 | 16 working days | Get Quote |
| 10 mg | 80 USD | 98 | 11 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-2470000007.sdf |
| SMILES | MCULE-2470000007.smiles |
| Standard InChI | MCULE-2470000007.inchi |
| InChIKey | MCULE-2470000007.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-610989448 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 11.723 g |
| P-489109139 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-580706810 | BLD pharm | In-stock building blocks | 98 | As is | 950 mg |
| P-871218985 | BOC Sciences | All products | N/A | As is | by resynthesis (? - ? days) |
| P-881633807 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-851278293 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861511038 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-852461624 | Matrix Scientific | All | N/A | As is | in stock |
| P-854711455 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-474023863 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-608277867 | Molnova | Stock | 98 | As is | in stock |
| P-579710730 | Selleckchem | Product Catalog | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 543.605 |
| logP | 5.6682 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 104.86 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 148.3389 |
| Atoms | 66 |
| Rings | 5 |
| Heavy atoms | 38 |
| Hydrogen atoms | 28 |
| Heteroatoms | 11 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
