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UNKNOWN STEREO
MCULE-3476445742
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 | 39 USD | 95 | 11 working days | Get Quote |
| 5 mg | 57 USD | 95 | 16 working days | Get Quote |
| 10 mg | 101 USD | 95 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3476445742.sdf |
| SMILES | MCULE-3476445742.smiles |
| Standard InChI | MCULE-3476445742.inchi |
| InChIKey | MCULE-3476445742.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867549519 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875707118 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869314373 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851639245 | AmBeed | On request | N/A | As is | by synthesis |
| P-865905183 | Angene | Building Blocks in stock | 98 | As is | unavailable |
| P-888632277 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869116841 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-872759406 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 268.226 |
| logP | -2.2689 |
| H-bond acceptors | 9 |
| H-bond donors | 4 |
| Rotatable bonds | 2 |
| PSA | 133.49 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 61.0951 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 12 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 |
