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UNKNOWN STEREO
MCULE-5498302807
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 | 7 USD | 97 | 22 working days | Get Quote |
| 5 mg | 7 USD | 97 | 22 working days | Get Quote |
| 10 mg | 7 USD | 97 | 22 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-5498302807.sdf |
| SMILES | MCULE-5498302807.smiles |
| Standard InChI | MCULE-5498302807.inchi |
| InChIKey | MCULE-5498302807.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867568755 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875728546 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-606944205 | AmBeed | In stock | N/A | As is | in stock |
| P-596929962 | Angene | Building Blocks in stock | 97 | As is | 6 kg |
| P-864106628 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893239935 | Biosynth | In Stock | 95 | As is | in stock |
| P-893240137 | Biosynth | In Stock | 95 | As is | in stock |
| P-580434412 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-488543073 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-617988256 | InterBioScreen | Natural Compounds | 95 | As is | 300 mg |
| P-454363367 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-500379254 | Pi Chemicals | Virtual Compounds | N/A | As is | by synthesis |
| P-500406459 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-2376336 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.495 g |
| P-464690136 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.495 g |
| P-615438976 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.208 |
| logP | -2.8441 |
| H-bond acceptors | 7 |
| H-bond donors | 5 |
| Rotatable bonds | 7 |
| PSA | 127.09 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 48.4189 |
| Atoms | 30 |
| Rings | 0 |
| Heavy atoms | 15 |
| Hydrogen atoms | 15 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
