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UNKNOWN STEREO
MCULE-7862181413
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 | 7 USD | 98 | 22 working days | Get Quote |
| 5 mg | 12 USD | 98 | 22 working days | Get Quote |
| 10 mg | 19 USD | N/A | 9 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-7862181413.sdf |
| SMILES | MCULE-7862181413.smiles |
| Standard InChI | MCULE-7862181413.inchi |
| InChIKey | MCULE-7862181413.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867570161 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875730712 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613854304 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606920498 | AmBeed | In stock | N/A | As is | in stock |
| P-596949331 | Angene | Building Blocks in stock | 98 | As is | 10 g |
| P-864125705 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893229029 | Biosynth | In Stock | 95 | As is | in stock |
| P-505550432 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-594273898 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892295452 | TargetMol | In Stock BB | 95 | As is | 942 mg |
| P-888656512 | TargetMol | Screening Compounds - stock amount | 95 | As is | 942 mg |
| P-611619539 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 436.880 |
| logP | 1.3565 |
| H-bond acceptors | 7 |
| H-bond donors | 4 |
| Rotatable bonds | 6 |
| PSA | 108.61 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 108.5222 |
| Atoms | 55 |
| Rings | 4 |
| Heavy atoms | 30 |
| Hydrogen atoms | 25 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
