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UNKNOWN STEREO
MCULE-4434952785
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 | 328 USD | 97 | 20 working days | Get Quote |
| 5 mg | 328 USD | 97 | 20 working days | Get Quote |
| 10 mg | 328 USD | 97 | 20 working days | Get Quote |
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1
MCULE-7044254507
- Component type: Main
-
1
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4434952785.sdf |
| SMILES | MCULE-4434952785.smiles |
| Standard InChI | MCULE-4434952785.inchi |
| InChIKey | MCULE-4434952785.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-860607325 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-881617500 | AmBeed | On request | N/A | As is | by synthesis |
| P-886746544 | A2B Chem | Predominantly Building Block in stock | 97 | Main component | in stock |
| P-890183773 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-872713463 | AmBeed | In stock | N/A | Main component | in stock |
| P-888827671 | Angene | Building Blocks in stock | 97 | Main component | 2 g |
| P-889785614 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-580405326 | Debye Scientific | General Catalog | 95 | Main component | by resynthesis (? - ? days) |
| P-886913429 | eNovation Chemicals LLC | Building Blocks in stock | 97 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 283.236 |
| logP | 1.2611 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 138.13 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 55.8706 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 10 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| Inorganic atoms | 1 |
| 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 |
