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UNKNOWN STEREO
MCULE-1412596642
Compound
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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 | 38 USD | 98 | 12 working days | Get Quote |
| 5 mg | 38 USD | 98 | 12 working days | Get Quote |
| 10 mg | 38 USD | 98 | 12 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-1412596642.sdf |
| SMILES | MCULE-1412596642.smiles |
| Standard InChI | MCULE-1412596642.inchi |
| InChIKey | MCULE-1412596642.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867599709 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875757687 | AA Blocks | AA Blocks | N/A | As is | in stock |
| P-590379809 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-881652984 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864114856 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-488543445 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-854552972 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
| P-524444390 | Key Organics | Biochemicals | 97 | As is | 5.03 g |
| P-454363589 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-500388023 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-869175785 | TargetMol | Natural Products | 95 | As is | 2.298 g |
| P-611401694 | Toronto Research | In stock | 90 | As is | in stock |
| P-615434391 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| P-868523702 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 330.460 |
| logP | 3.8384 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 54.37 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 95.2108 |
| Atoms | 54 |
| Rings | 4 |
| Heavy atoms | 24 |
| Hydrogen atoms | 30 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
