Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3905328599
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 | 13 USD | 95 | 16 working days | Get Quote |
| 5 mg | 13 USD | 95 | 16 working days | Get Quote |
| 10 mg | 13 USD | 95 | 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-3905328599.sdf |
| SMILES | MCULE-3905328599.smiles |
| Standard InChI | MCULE-3905328599.inchi |
| InChIKey | MCULE-3905328599.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867558183 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875718177 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535624358 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-610992260 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 30.03 g |
| P-606848805 | AmBeed | In stock | N/A | As is | in stock |
| P-489146826 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-597007238 | Angene | Building Blocks in stock | 95 | As is | 4.9 g |
| P-866727623 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864114136 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-481172268 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 8 g |
| P-615696631 | BLD pharm | In-stock building blocks | 95 | As is | 6 g |
| P-851302301 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868585131 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-889110236 | FluoroChem | In Stock BB | N/A | As is | 2 g |
| P-454319256 | Key Organics | Screening Compounds and Fragments | 90 | As is | 731 mg |
| P-579654043 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-31257582 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580502351 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852376818 | Matrix Scientific | All | N/A | As is | in stock |
| P-854756135 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-889871249 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502400379 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611368222 | Toronto Research | In stock | 90 | As is | in stock |
| P-886967584 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 210.579 |
| logP | 2.8511 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 42.5818 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 5 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| 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 |
