Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6502575594
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 | 9 USD | 96 | 20 working days | Get Quote |
| 5 mg | 9 USD | 96 | 20 working days | Get Quote |
| 10 mg | 9 USD | 96 | 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-6502575594.sdf |
| SMILES | MCULE-6502575594.smiles |
| Standard InChI | MCULE-6502575594.inchi |
| InChIKey | MCULE-6502575594.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867623877 | A2B Chem | Predominantly Building Block in stock | 96 | As is | in stock |
| P-875786311 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590384646 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-610984244 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 494.37 g |
| P-436468821 | Alinda | Building Blocks | 95 | As is | in stock |
| P-606935961 | AmBeed | In stock | N/A | As is | in stock |
| P-489225027 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596964932 | Angene | Building Blocks in stock | 96 | As is | 75 g |
| P-589656579 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864133015 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590605190 | BLD pharm | In-stock building blocks | 96 | As is | 1.35 g |
| P-454629798 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-851278951 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-861281224 | Chiralstar | Chiralstar Building Blocks | 97 | As is | in stock |
| P-868589877 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-901379541 | FluoroChem | In Stock BB | N/A | As is | 250 mg |
| P-505544315 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502529818 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-492241902 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454316616 | Key Organics | Screening Compounds and Fragments | 90 | As is | unavailable |
| P-608090400 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-14058182 | Life Chemicals | Building Blocks | 95 | As is | 3.545 g |
| P-601066952 | Life Chemicals | Screening Compounds | 90 | As is | 3.545 g |
| P-852452091 | Matrix Scientific | All | N/A | As is | in stock |
| P-854750931 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-19305961 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885519143 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502361891 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611580592 | Toronto Research | In stock | 90 | As is | in stock |
| P-25504180 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 78 mg |
| P-615397688 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 181.145 |
| logP | 0.5664 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 76.49 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 42.4758 |
| Atoms | 20 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 7 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
