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UNKNOWN STEREO
MCULE-4649420265-0
Structure
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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 | 11 USD | 95 | 20 working days | Get Quote |
| 5 mg | 11 USD | 95 | 20 working days | Get Quote |
| 10 mg | 11 USD | 95 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-8260809699-0
- Component type: Unknown
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MCULE-3291766807-0
- Component type: Main
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MCULE-4066113752-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4649420265-0.sdf |
| SMILES | MCULE-4649420265-0.smiles |
| Standard InChI | MCULE-4649420265-0.inchi |
| InChIKey | MCULE-4649420265-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867641492 | A2B Chem | Predominantly Building Block in stock | 99 | As a main component | in stock |
| P-894620235 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-851398797 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-873295894 | Angene | Building Blocks in stock | 97 | As a main component | 100 mg |
| P-865907493 | Angene | Building Blocks in stock | 95 | As a main component | 175 g |
| P-881654059 | Apexbio Technology | Bioactive Compound Library | 98 | As a main component | in stock |
| P-864263943 | AstaTech | Backordered BBs | 95 | As a main component | by synthesis |
| P-864193868 | AstaTech | In Stock BBs | 95 | As a main component | in stock |
| P-893235983 | Biosynth | In Stock | 95 | As a main component | in stock |
| P-893235642 | Biosynth | In Stock | 95 | As a main component | in stock |
| P-893235427 | Biosynth | In Stock | 95 | As a main component | in stock |
| P-893253186 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-893260494 | Biosynth | Synthesis | 95 | As a main component | by synthesis |
| P-892263542 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-869118693 | TargetMol | Screening Compounds - synthesis | 95 | As a main component | by synthesis |
| P-892288890 | TargetMol | In Stock BB | 95 | As a main component | unavailable |
| P-892344854 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | unavailable |
| P-888633724 | TargetMol | Screening Compounds - stock amount | 95 | As a main component | 100 mg |
| P-854985152 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-505494863 | Hangzhou Apichem | Building Blocks in stock | 95 | As a component | in stock |
| P-500377175 | Pi Chemicals | Virtual Compounds | 98 | As a component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 198.152 |
| logP | -2.4924 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 89.9 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.9553 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
