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UNKNOWN STEREO
MCULE-4974199679-0
Structure
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- 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 | 39 USD | 95 | 9 working days | Get Quote |
| 5 mg | 39 USD | 95 | 9 working days | Get Quote |
| 10 mg | 39 USD | 95 | 9 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-4974199679-0.sdf |
| SMILES | MCULE-4974199679-0.smiles |
| Standard InChI | MCULE-4974199679-0.inchi |
| InChIKey | MCULE-4974199679-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-881654660 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-889457859 | AstaTech | Backordered BBs | 98 | As is | by synthesis |
| P-893237269 | Biosynth | In Stock | 95 | As is | in stock |
| P-488555601 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-488545471 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-35186899 | Maybridge | Screening Collection | 90 | As is | 872 g |
| P-454365697 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-500387737 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-516408008 | Specs | Natural Products | 80 | As is | 6.846 g |
| P-896087961 | Specs | Natural Products | 80 | As is | 5 mg |
| P-896087933 | Specs | Natural Products | 80 | As is | 4.336 g |
| P-892246929 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869176707 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892293932 | TargetMol | In Stock BB | 95 | As is | 1.052 g |
| P-892333580 | TargetMol | Screening Compounds - stock amount | 95 | As is | 1.052 g |
| P-855014121 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 246.301 |
| logP | 2.4196 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 43.37 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 68.154 |
| Atoms | 36 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 18 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
