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UNKNOWN STEREO
MCULE-3043933628-0
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 | 51 USD | 95 | 7 working days | Get Quote |
| 5 mg | 112 USD | 95 | 7 working days | Get Quote |
| 10 mg | 194 USD | 95 | 7 working days | Get Quote |
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1
MCULE-1684552169-1
- Component type: Main
-
1
MCULE-9976402631-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3043933628-0.sdf |
| SMILES | MCULE-3043933628-0.smiles |
| Standard InChI | MCULE-3043933628-0.inchi |
| InChIKey | MCULE-3043933628-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886768605 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-895113274 | Angene | Building Blocks in stock | N/A | As is | 10 mg |
| P-901347028 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-893258973 | Biosynth | Synthesis | 95 | Main component | by synthesis |
| P-869172896 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892301873 | TargetMol | In Stock BB | 95 | Main component | unavailable |
| P-888664110 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 50 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 1247.346 |
| logP | 1.6864 |
| H-bond acceptors | 33 |
| H-bond donors | 17 |
| Rotatable bonds | 47 |
| PSA | 526.07 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 301.0354 |
| Atoms | 167 |
| Rings | 2 |
| Heavy atoms | 86 |
| Hydrogen atoms | 81 |
| Heteroatoms | 34 |
| N/O atoms | 30 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
