Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9742035803
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 | 21 USD | 95 | 22 working days | Get Quote |
| 5 mg | 21 USD | 95 | 22 working days | Get Quote |
| 10 mg | 21 USD | 95 | 22 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-9742035803.sdf |
| SMILES | MCULE-9742035803.smiles |
| Standard InChI | MCULE-9742035803.inchi |
| InChIKey | MCULE-9742035803.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867607292 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875765858 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590356986 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893570759 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 66.25 g |
| P-436452151 | Alinda | Building Blocks | 95 | As is | in stock |
| P-606945672 | AmBeed | In stock | N/A | As is | in stock |
| P-865913609 | Angene | Building Blocks in stock | 95 | As is | 66.25 g |
| P-589664517 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864125388 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-666963520 | BLD pharm | In-stock building blocks | 95 | As is | 6.25 g |
| P-492256822 | ChemBridge | Building Block Library | 95 | As is | in stock |
| P-4153189 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
| P-619934025 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
| P-861498937 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580784621 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-862041094 | FluoroChem | General BB | 95 | As is | in stock |
| P-563523603 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-852406292 | Matrix Scientific | All | N/A | As is | in stock |
| P-854920891 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-491136518 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-873283541 | Shanghai iChemical | In stock | N/A | As is | in stock |
| P-33471803 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502358293 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611579359 | Toronto Research | In stock | 90 | As is | in stock |
| P-872755264 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.151 |
| logP | 2.0391 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 64.94 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.0964 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| 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 |
