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UNKNOWN STEREO
MCULE-5852778653
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 | 33 USD | 90 | 23 working days | Get Quote |
| 5 mg | 51 USD | 90 | 17 working days | Get Quote |
| 10 mg | 65 USD | 90 | 17 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-5852778653.sdf |
| SMILES | MCULE-5852778653.smiles |
| Standard InChI | MCULE-5852778653.inchi |
| InChIKey | MCULE-5852778653.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852093420 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-874636201 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-864330523 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-579798985 | Eximed | In-stock screening compounds | 90 | As is | 2.969 g |
| P-580088760 | Eximed | Building Block Catalog | 95 | As is | 2.969 g |
| P-492246135 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502967585 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-488543699 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13901563 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
| P-34031891 | Otava | In-House Stock Library | 90 | As is | 3.22 g |
| P-620225267 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 3.22 g |
| P-454363647 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-855244459 | Toronto Research | In stock | 90 | As is | in stock |
| P-2252567 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.013 g |
| P-3227318 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.013 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 272.252 |
| logP | 2.5099 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 1 |
| PSA | 86.99 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 71.5705 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 12 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
