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UNKNOWN STEREO
MCULE-5729208251
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 | 62 USD | 95 | 11 working days | Get Quote |
| 5 mg | 192 USD | 95 | 11 working days | Get Quote |
| 10 mg | 286 USD | 95 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5729208251.sdf |
| SMILES | MCULE-5729208251.smiles |
| Standard InChI | MCULE-5729208251.inchi |
| InChIKey | MCULE-5729208251.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875826968 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-596971657 | Angene | Building Blocks in stock | 99 | As is | 250 mg |
| P-864244439 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-869177797 | TargetMol | Natural Products | 95 | As is | 659 mg |
| P-855315347 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 472.698 |
| logP | 5.8401 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 70.06 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 137.8866 |
| Atoms | 82 |
| Rings | 5 |
| Heavy atoms | 34 |
| Hydrogen atoms | 48 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
