Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9338504001-0
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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 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-3593523223-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9338504001-0.sdf |
| SMILES | MCULE-9338504001-0.smiles |
| Standard InChI | MCULE-9338504001-0.inchi |
| InChIKey | MCULE-9338504001-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886599874 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889922020 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-613849573 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851798606 | AmBeed | On request | N/A | As is | by synthesis |
| P-889818479 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590991496 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-852422597 | Matrix Scientific | All | N/A | As is | in stock |
| P-854871748 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-611573255 | Toronto Research | In stock | 90 | As is | in stock |
| P-893778066 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-867412693 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-894642136 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851474937 | AmBeed | On request | N/A | Main component | by synthesis |
| P-864251964 | AstaTech | Backordered BBs | 95 | Main component | by synthesis |
| P-590853437 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-874533773 | ChemDiv | Discovery Chemistry Library | 90 | Main component | unavailable |
| P-502505481 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-488551608 | InterBioScreen | Building Blocks | 90 | Main component | in stock |
| P-13755381 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-596595770 | Key Organics | Building Blocks | 90 | Main component | 1000 mg |
| P-854890839 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-454369563 | Pharmeks LLC | Building Blocks | 92 | Main component | in stock |
| P-13920385 | Pharmeks LLC | Synthetic compounds | 92 | Main component | 300 mg |
| P-579440405 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-491077755 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | Main component | by synthesis |
| P-35131699 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 1000 mg |
| P-464686401 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | Main component | 1000 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 166.648 |
| logP | 1.6105 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 43.6301 |
| Atoms | 25 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 15 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
