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UNKNOWN STEREO
MCULE-9414813622
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 | 45 USD | 95 | 15 working days | Get Quote |
| 5 mg | 45 USD | 95 | 15 working days | Get Quote |
| 10 mg | 45 USD | 95 | 15 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-9414813622.sdf |
| SMILES | MCULE-9414813622.smiles |
| Standard InChI | MCULE-9414813622.inchi |
| InChIKey | MCULE-9414813622.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-889930899 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-613851982 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-881618008 | AmBeed | On request | N/A | As is | by synthesis |
| P-895101352 | Angene | Building Blocks in stock | 99 | As is | 5 g |
| P-889590580 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893242165 | Biosynth | In Stock | 95 | As is | in stock |
| P-500385495 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-892283627 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892309628 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892301853 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-892356618 | TargetMol | Screening Compounds - stock amount | 95 | As is | 1.056 g |
| P-611437024 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 258.228 |
| logP | -2.5435 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 2 |
| PSA | 124.78 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 59.2351 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
