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UNKNOWN STEREO
MCULE-2635091853
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 | 39 USD | 95 | 11 working days | Get Quote |
| 5 mg | 75 USD | 95 | 11 working days | Get Quote |
| 10 mg | 105 USD | 95 | 11 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-2635091853.sdf |
| SMILES | MCULE-2635091853.smiles |
| Standard InChI | MCULE-2635091853.inchi |
| InChIKey | MCULE-2635091853.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867661533 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-612940335 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-580247531 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606838451 | AmBeed | In stock | N/A | As is | in stock |
| P-596972689 | Angene | Building Blocks in stock | 98 | As is | 1000 mg |
| P-881654881 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-881654162 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864147729 | AstaTech | In Stock BBs | 96 | As is | in stock |
| P-505524673 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-869176452 | TargetMol | Natural Products | 95 | As is | 300 mg |
| P-869177951 | TargetMol | Natural Products | 95 | As is | 438 mg |
| P-666970542 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 516.449 |
| logP | 1.0296 |
| H-bond acceptors | 12 |
| H-bond donors | 7 |
| Rotatable bonds | 9 |
| PSA | 211.28 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 126.8964 |
| Atoms | 61 |
| Rings | 3 |
| Heavy atoms | 37 |
| Hydrogen atoms | 24 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| 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 | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
