Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9492558690
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 | 5 USD | 98 | 16 working days | Get Quote |
| 5 mg | 5 USD | 98 | 16 working days | Get Quote |
| 10 mg | 5 USD | 98 | 16 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-9492558690.sdf |
| SMILES | MCULE-9492558690.smiles |
| Standard InChI | MCULE-9492558690.inchi |
| InChIKey | MCULE-9492558690.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867542110 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875699214 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597027229 | AEchem | Building blocks | 97 | As is | in stock |
| P-505388742 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-881671859 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-580198986 | Aldlab Chemicals | Building Block Stock | 95 | As is | 8.879 kg |
| P-606913247 | AmBeed | In stock | N/A | As is | in stock |
| P-489175798 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596926309 | Angene | Building Blocks in stock | 98 | As is | 99.92 g |
| P-494319877 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864101795 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580719734 | BLD pharm | In-stock building blocks | 97 | As is | 222 g |
| P-868641988 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580281204 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861918692 | FluoroChem | General BB | N/A | As is | in stock |
| P-870655793 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505491570 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492243164 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454301030 | Key Organics | Screening Compounds and Fragments | 90 | As is | 435 mg |
| P-31208046 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-613276513 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580464776 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
| P-852378019 | Matrix Scientific | All | N/A | As is | in stock |
| P-428001851 | Maybridge | Screening Collection | 90 | As is | 15.5 kg |
| P-854731760 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-34009834 | Otava | In-House Stock Library | 90 | As is | 1.51 g |
| P-500403334 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-885542876 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596761971 | Synthonix | In-stock Building Blocks | 97 | As is | 5.116 kg |
| P-502331103 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611402228 | Toronto Research | In stock | 90 | As is | in stock |
| P-615391712 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 156.129 |
| logP | 2.1674 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 36.5525 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 6 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
