Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6644374369
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 | 33 USD | 90 | 23 working days | Get Quote |
| 5 mg | 35 USD | 95 | 14 working days | Get Quote |
| 10 mg | 41 USD | 95 | 14 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-6644374369.sdf |
| SMILES | MCULE-6644374369.smiles |
| Standard InChI | MCULE-6644374369.inchi |
| InChIKey | MCULE-6644374369.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612840252 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-889937398 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-590358238 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-436462495 | Alinda | Building Blocks | 95 | As is | 1000 mg |
| P-851649252 | AmBeed | On request | N/A | As is | by synthesis |
| P-596498822 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-596469330 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-590879517 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-3777788 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 1 mg |
| P-577133231 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-6858647 | ChemDiv | Discovery Chemistry Library | 90 | As is | 13 mg |
| P-868576120 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-428588105 | Eximed | In-stock screening compounds | 90 | As is | 2.78 g |
| P-492272479 | Eximed | Building Block Catalog | 95 | As is | 2.78 g |
| P-861974682 | FluoroChem | General BB | N/A | As is | in stock |
| P-492246307 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502967570 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502473967 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-563682261 | Key Organics | Building Blocks | 95 | As is | 100 mg |
| P-852387531 | Matrix Scientific | All | N/A | As is | in stock |
| P-854830760 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-492284578 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 3.78 g |
| P-34052028 | Otava | In-House Stock Library | 90 | As is | 3.78 g |
| P-856065411 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 3.78 g |
| P-19519290 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-502340495 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611376676 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 237.252 |
| logP | 2.5763 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 78.43 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 59.0528 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| 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 |
