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UNKNOWN STEREO
MCULE-4230201166
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 | 52 USD | 95 | 9 working days | Get Quote |
| 5 mg | 163 USD | 95 | 9 working days | Get Quote |
| 10 mg | 266 USD | 95 | 9 working days | Get Quote |
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MCULE-4627147558
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4230201166.sdf |
| SMILES | MCULE-4230201166.smiles |
| Standard InChI | MCULE-4230201166.inchi |
| InChIKey | MCULE-4230201166.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867625202 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875787724 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-596932896 | Angene | Building Blocks in stock | 95 | As is | 500 mg |
| P-864199588 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-504618543 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-869116033 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892288199 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888631711 | TargetMol | Screening Compounds - stock amount | 95 | As is | 200 mg |
| P-886926254 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| P-869116034 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-888631712 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | unavailable |
| P-611506083 | Toronto Research | In stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 410.891 |
| logP | 4.9042 |
| H-bond acceptors | 5 |
| H-bond donors | 4 |
| Rotatable bonds | 9 |
| PSA | 81.59 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 116.0245 |
| Atoms | 52 |
| Rings | 3 |
| Heavy atoms | 29 |
| Hydrogen atoms | 23 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
