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UNKNOWN STEREO
MCULE-9069730712-0
Structure
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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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9069730712-0.sdf |
| SMILES | MCULE-9069730712-0.smiles |
| Standard InChI | MCULE-9069730712-0.inchi |
| InChIKey | MCULE-9069730712-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892854347 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-890143665 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613851616 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851657435 | AmBeed | On request | N/A | As is | by synthesis |
| P-865907885 | Angene | Building Blocks in stock | 98 | As is | 1000 g |
| P-881654580 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-896023795 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893244104 | Biosynth | In Stock | 95 | As is | in stock |
| P-892227899 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869175965 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892290760 | TargetMol | In Stock BB | 95 | As is | 999 mg |
| P-892321390 | TargetMol | Screening Compounds - stock amount | 95 | As is | 999 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 344.312 |
| logP | -5.7612 |
| H-bond acceptors | 11 |
| H-bond donors | 9 |
| Rotatable bonds | 8 |
| PSA | 200.53 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 70.3102 |
| Atoms | 47 |
| Rings | 1 |
| Heavy atoms | 23 |
| Hydrogen atoms | 24 |
| Heteroatoms | 11 |
| N/O atoms | 11 |
| 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 |
