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UNKNOWN STEREO
MCULE-1208976029
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.
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|
|---|---|---|---|---|
| 1 mg | 6 USD | N/A | 9 working days | Get Quote |
| 5 mg | 6 USD | N/A | 9 working days | Get Quote |
| 10 mg | 6 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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MCULE-2091493043
- Component type: Unknown
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MCULE-5008337030
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1208976029.sdf |
| SMILES | MCULE-1208976029.smiles |
| Standard InChI | MCULE-1208976029.inchi |
| InChIKey | MCULE-1208976029.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867565646 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875724686 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-608441941 | Aldlab Chemicals | Building Block Stock | 95 | As is | 100 g |
| P-606920350 | AmBeed | In stock | N/A | As is | in stock |
| P-596928907 | Angene | Building Blocks in stock | 98 | As is | 4 kg |
| P-580196120 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864158934 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-893229660 | Biosynth | In Stock | 95 | As is | in stock |
| P-505492790 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-890851073 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492243843 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-13924129 | InterBioScreen | Natural Compounds | 92 | As is | 164 mg |
| P-881190179 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-881187777 | Otava | In-House Stock Library | 90 | As is | 50 mg |
| P-500399985 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-892213307 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-869175312 | TargetMol | Natural Products | 95 | As is | in stock |
| P-892286155 | TargetMol | In Stock BB | 95 | As is | 1.003 g |
| P-892309719 | TargetMol | Screening Compounds - stock amount | 95 | As is | 1.003 g |
| P-611522596 | Toronto Research | In stock | 90 | As is | in stock |
| P-611495269 | Toronto Research | In stock | 90 | As is | in stock |
| P-892941231 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 441.397 |
| logP | 1.4126 |
| H-bond acceptors | 13 |
| H-bond donors | 6 |
| Rotatable bonds | 10 |
| PSA | 213.54 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 111.1159 |
| Atoms | 51 |
| Rings | 3 |
| Heavy atoms | 32 |
| Hydrogen atoms | 19 |
| Heteroatoms | 13 |
| N/O atoms | 13 |
| 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 |
