Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9669802865
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 | 8 USD | 95 | 20 working days | Get Quote |
| 5 mg | 8 USD | 95 | 20 working days | Get Quote |
| 10 mg | 8 USD | 95 | 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-9669802865.sdf |
| SMILES | MCULE-9669802865.smiles |
| Standard InChI | MCULE-9669802865.inchi |
| InChIKey | MCULE-9669802865.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867572343 | A2B Chem | Predominantly Building Block in stock | N/A | As is | in stock |
| P-875732998 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-610977418 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 84.883 g |
| P-606915458 | AmBeed | In stock | N/A | As is | in stock |
| P-489223164 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596950076 | Angene | Building Blocks in stock | 95 | As is | 15 g |
| P-494423946 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864126503 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-584628191 | BLD pharm | In-stock building blocks | 95 | As is | 1.35 g |
| P-851269185 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868640834 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580420505 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-500246607 | Diverchim | Diverchim General Catalog | N/A | As is | in stock |
| P-862090915 | FluoroChem | General BB | 95 | As is | in stock |
| P-860783849 | Iris Biotech GmbH | Building Block Library | N/A | As is | in stock |
| P-563497021 | Key Organics | Building Blocks | 95 | As is | 1000 mg |
| P-579611730 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31175454 | LaboTest | Screening Collection | 90 | As is | 100 mg |
| P-860789234 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852411693 | Matrix Scientific | All | N/A | As is | in stock |
| P-854758044 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-888888989 | PharmaBlock | In stock | N/A | As is | in stock |
| P-502339574 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22526181 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 50 mg |
| P-615394805 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 277.315 |
| logP | 2.8283 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 75.63 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 74.0775 |
| Atoms | 39 |
| Rings | 2 |
| Heavy atoms | 20 |
| Hydrogen atoms | 19 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
