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MCULE-1981406552
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 | 134 USD | 97 | 15 working days | Get Quote |
| 5 mg | 134 USD | 97 | 15 working days | Get Quote |
| 10 mg | 134 USD | 97 | 15 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-1981406552.sdf |
| SMILES | MCULE-1981406552.smiles |
| Standard InChI | MCULE-1981406552.inchi |
| InChIKey | MCULE-1981406552.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-892787972 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-878260078 | AmBeed | In stock | N/A | As is | in stock |
| P-889785355 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-878233876 | BLD pharm | In-stock building blocks | 97 | As is | 65.45 g |
| P-889729773 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-492216619 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502738816 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502494073 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-504527136 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-852553004 | Matrix Scientific | All | N/A | As is | in stock |
| P-33883933 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-502352156 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.236 |
| logP | 1.89998 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 59.32 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.762 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
