Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8813853562
Compound
Show structures
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 | 8 USD | 98 | 22 working days | Get Quote |
| 5 mg | 8 USD | 98 | 22 working days | Get Quote |
| 10 mg | 8 USD | 98 | 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-8813853562.sdf |
| SMILES | MCULE-8813853562.smiles |
| Standard InChI | MCULE-8813853562.inchi |
| InChIKey | MCULE-8813853562.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867605718 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875764066 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597028350 | AEchem | Building blocks | 97 | As is | in stock |
| P-590404492 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893505575 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 254.823 g |
| P-606870549 | AmBeed | In stock | N/A | As is | in stock |
| P-867722759 | AmBeed | On request | N/A | As is | by synthesis |
| P-489230756 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596960878 | Angene | Building Blocks in stock | 98 | As is | 25 g |
| P-864104572 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-864159169 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-852217576 | BLD pharm | Non-stock building blocks | 97 | As is | by synthesis |
| P-580703736 | BLD pharm | In-stock building blocks | 98 | As is | 21.25 g |
| P-851281266 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868563159 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-868605746 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-34526070 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-580778973 | Crea-Chim | Building Blocks | 95 | As is | by resynthesis (? - ? days) |
| P-580768175 | Crea-Chim | Prepacked BB compounds with prompt delivery | 95 | As is | in stock |
| P-580376314 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-861946220 | FluoroChem | General BB | 95 | As is | in stock |
| P-890212948 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579526360 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | 5.9 g |
| P-454412127 | Key Organics | Building Blocks | 95 | As is | 9.442 g |
| P-18811755 | Key Organics | Screening Compounds and Fragments | 95 | As is | 9.442 g |
| P-615651544 | LabNetwork | In stock | 95 | As is | in stock |
| P-613362784 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-852415746 | Matrix Scientific | All | N/A | As is | in stock |
| P-854732800 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-888902989 | PharmaBlock | In stock | N/A | As is | in stock |
| P-23869525 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596768462 | Synthonix | In-stock Building Blocks | 98 | As is | 313.5 g |
| P-33488630 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502344549 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22631955 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 12 mg |
| P-854988323 | Toronto Research | In stock | 90 | As is | in stock |
| P-855076804 | Toronto Research | In stock | 90 | As is | in stock |
| P-596528270 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.023 g |
| P-1176378 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.023 g |
| P-893969657 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 185.138 |
| logP | 1.0178 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 100.8 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 43.4962 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 7 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| 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 |
