Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6773612714
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 | 20 USD | N/A | 35 working days | Get Quote |
| 5 mg | 20 USD | N/A | 35 working days | Get Quote |
| 10 mg | 20 USD | N/A | 35 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-6773612714.sdf |
| SMILES | MCULE-6773612714.smiles |
| Standard InChI | MCULE-6773612714.inchi |
| InChIKey | MCULE-6773612714.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869272183 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893551916 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 45.5 g |
| P-34885372 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-893300604 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-494412385 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864261695 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-901431372 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-889031741 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-901403838 | FluoroChem | General BB | N/A | As is | in stock |
| P-579484139 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 1.381 g |
| P-890204531 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-454420025 | Key Organics | Building Blocks | 90 | As is | 999 mg |
| P-454356517 | Key Organics | Screening Compounds and Fragments | 90 | As is | 999 mg |
| P-601072143 | Life Chemicals | Screening Compounds | 90 | As is | 204 mg |
| P-852484370 | Matrix Scientific | All | N/A | As is | in stock |
| P-855400475 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-878648275 | Molnova | Stock | 98 | As is | in stock |
| P-19648433 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-859956236 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-869161346 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295597 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888656582 | TargetMol | Screening Compounds - stock amount | 95 | As is | 197 mg |
| P-873228497 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611612285 | Toronto Research | In stock | 90 | As is | in stock |
| P-3001063 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 34 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 231.290 |
| logP | 3.5297 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 42.23 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 69.3873 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 17 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
