Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7699599383
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 | 15 USD | 95 | 8 working days | Get Quote |
| 5 mg | 15 USD | 95 | 8 working days | Get Quote |
| 10 mg | 15 USD | 95 | 8 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-7699599383.sdf |
| SMILES | MCULE-7699599383.smiles |
| Standard InChI | MCULE-7699599383.inchi |
| InChIKey | MCULE-7699599383.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852194718 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-852194736 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867523822 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-590416869 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893447384 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 54.65 g |
| P-606837832 | AmBeed | In stock | N/A | As is | in stock |
| P-489159351 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-864193204 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590626985 | BLD pharm | In-stock building blocks | 95 | As is | 7.6 g |
| P-861339950 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-580441949 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862023405 | FluoroChem | General BB | 95 | As is | in stock |
| P-596564536 | Key Organics | Building Blocks | 95 | As is | 250 mg |
| P-615656452 | LabNetwork | In stock | 95 | As is | in stock |
| P-31194779 | LaboTest | Screening Collection | 90 | As is | 200 mg |
| P-888873757 | PharmaBlock | In stock | N/A | As is | in stock |
| P-855360792 | Toronto Research | In stock | 90 | As is | in stock |
| P-893995520 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 147.129 |
| logP | -0.1807 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 3 |
| PSA | 100.62 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 32.4 |
| Atoms | 19 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 9 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
