Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9726561714
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 | 9 USD | 80 | 20 working days | Get Quote |
| 5 mg | 9 USD | 80 | 20 working days | Get Quote |
| 10 mg | 9 USD | 80 | 20 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-9726561714.sdf |
| SMILES | MCULE-9726561714.smiles |
| Standard InChI | MCULE-9726561714.inchi |
| InChIKey | MCULE-9726561714.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867587268 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875745692 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869184850 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505389664 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-893575357 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 2.94134 kg |
| P-606923406 | AmBeed | In stock | N/A | As is | in stock |
| P-489154100 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596954500 | Angene | Building Blocks in stock | 80 | As is | 1000 g |
| P-864185273 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580708736 | BLD pharm | In-stock building blocks | 92 | As is | 140 g |
| P-901457460 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-868577490 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580302812 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-901375296 | FluoroChem | In Stock BB | N/A | As is | 21.5 g |
| P-870658259 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505509696 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-524164604 | Key Organics | Building Blocks | 97 | As is | 25 g |
| P-856005861 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-579619365 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-31257030 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-852483882 | Matrix Scientific | All | N/A | As is | in stock |
| P-895220709 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500403944 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-500393453 | Pi Chemicals | Virtual Compounds | N/A | As is | by synthesis |
| P-885535957 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-611454902 | Toronto Research | In stock | 90 | As is | in stock |
| P-855009053 | Toronto Research | In stock | 90 | As is | in stock |
| P-575330679 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.237 |
| logP | 1.7514 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 43.37 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 56.928 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 14 |
| 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 |
