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UNKNOWN STEREO
MCULE-5334819173
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 | 72 USD | 95 | 11 working days | Get Quote |
| 5 mg | 290 USD | 95 | 11 working days | Get Quote |
| 10 mg | 523 USD | 95 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5334819173.sdf |
| SMILES | MCULE-5334819173.smiles |
| Standard InChI | MCULE-5334819173.inchi |
| InChIKey | MCULE-5334819173.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867678556 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875855761 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869180273 | TargetMol | Natural Products | 95 | As is | 558 mg |
| P-855051343 | Toronto Research | In stock | 90 | As is | in stock |
| P-868528693 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1132.296 |
| logP | 2.0518 |
| H-bond acceptors | 27 |
| H-bond donors | 15 |
| Rotatable bonds | 42 |
| PSA | 464.1 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 292.1127 |
| Atoms | 153 |
| Rings | 4 |
| Heavy atoms | 80 |
| Hydrogen atoms | 73 |
| Heteroatoms | 28 |
| N/O atoms | 27 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 9 |
| R/S chiral centers | 9 |
| 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 |
