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UNKNOWN STEREO
MCULE-9752754481
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.
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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 | 8 USD | N/A | 14 working days | Get Quote |
| 5 mg | 10 USD | N/A | 14 working days | Get Quote |
| 10 mg | 19 USD | N/A | 14 working days | Get Quote |
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MCULE-8626179110
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9752754481.sdf |
| SMILES | MCULE-9752754481.smiles |
| Standard InChI | MCULE-9752754481.inchi |
| InChIKey | MCULE-9752754481.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869357046 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851866910 | AmBeed | On request | N/A | As is | by synthesis |
| P-887315580 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-488556314 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-674714915 | Pharmeks LLC | Natural & unique compounds | 92 | As is | 76 mg |
| P-888639121 | TargetMol | Screening Compounds | 95 | As is | by synthesis |
| P-869125562 | TargetMol | Screening Compounds - stock amount | 95 | As is | in stock |
| P-606934370 | AmBeed | In stock | N/A | As a main component | in stock |
| P-864192255 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-24484808 | InterBioScreen | Natural Compounds | 92 | As a main component | 300 mg |
| P-615407406 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 612.623 |
| logP | 4.4004 |
| H-bond acceptors | 13 |
| H-bond donors | 5 |
| Rotatable bonds | 10 |
| PSA | 200.01 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 160.0154 |
| Atoms | 80 |
| Rings | 4 |
| Heavy atoms | 44 |
| Hydrogen atoms | 36 |
| Heteroatoms | 13 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
