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UNKNOWN STEREO
MCULE-3704989643-0
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3704989643-0.sdf |
| SMILES | MCULE-3704989643-0.smiles |
| Standard InChI | MCULE-3704989643-0.inchi |
| InChIKey | MCULE-3704989643-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867571741 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875731965 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869193167 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505352586 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606852375 | AmBeed | In stock | N/A | As is | in stock |
| P-851151247 | Angene | Building Blocks in stock | 98 | As is | 489 g |
| P-864193985 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-893265469 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-488543600 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-854587989 | InterBioScreen | Natural Compounds | 92 | As is | 300 mg |
| P-454363618 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-892263574 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892344885 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 394.336 |
| logP | -0.5565 |
| H-bond acceptors | 12 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 151.7 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 90.3067 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 18 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| 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 |
