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UNKNOWN STEREO
MCULE-1701708007-0
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 | 47 USD | 95 | 9 working days | Get Quote |
| 5 mg | 119 USD | 95 | 9 working days | Get Quote |
| 10 mg | 171 USD | N/A | 9 working days | Get Quote |
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1
MCULE-9086695374-0
- Component type: Main
-
1
MCULE-6572487779-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1701708007-0.sdf |
| SMILES | MCULE-1701708007-0.smiles |
| Standard InChI | MCULE-1701708007-0.inchi |
| InChIKey | MCULE-1701708007-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-889496370 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-893227822 | Biosynth | In Stock | 95 | As is | in stock |
| P-580450744 | CliniSciences S.A.S | All products | 99 | As is | in stock |
| P-427936083 | InterBioScreen | Natural Compounds | 92 | As is | 46 mg |
| P-869109848 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892287399 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888628333 | TargetMol | Screening Compounds - stock amount | 95 | As is | 6.181 g |
| P-875717374 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-895094340 | Angene | Building Blocks in stock | 98 | Main component as a main component | 100 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 707.837 |
| logP | 3.5066 |
| H-bond acceptors | 13 |
| H-bond donors | 4 |
| Rotatable bonds | 6 |
| PSA | 180.96 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 197.095 |
| Atoms | 95 |
| Rings | 8 |
| Heavy atoms | 50 |
| Hydrogen atoms | 45 |
| Heteroatoms | 14 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 7 |
| R/S chiral centers | 7 |
| 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 |
