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UNKNOWN STEREO
MCULE-9470021003
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 | 4 USD | N/A | 10 working days | Get Quote |
| 5 mg | 4 USD | N/A | 10 working days | Get Quote |
| 10 mg | 4 USD | N/A | 10 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-9470021003.sdf |
| SMILES | MCULE-9470021003.smiles |
| Standard InChI | MCULE-9470021003.inchi |
| InChIKey | MCULE-9470021003.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867585421 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875743978 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869193415 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505350121 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580197880 | Aldlab Chemicals | Building Block Stock | 95 | As is | 290.828 g |
| P-606843789 | AmBeed | In stock | N/A | As is | in stock |
| P-596954130 | Angene | Building Blocks in stock | 99 | As is | 10 kg |
| P-864087264 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-579721734 | CNH Technologies | In-stock Building Blocks | N/A | As is | unavailable |
| P-580429125 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-428631260 | Eximed | In-stock screening compounds | 90 | As is | 4.75 g |
| P-505506949 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-580005952 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502967197 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488544241 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-613281347 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-502372033 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-855000281 | Toronto Research | In stock | 90 | As is | in stock |
| P-615392834 | eNovation Chemicals LLC | Building Blocks in stock | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 215.246 |
| logP | 1.4084 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 66.84 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 58.3648 |
| Atoms | 32 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 17 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
