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MCULE-4680595689
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 | 39 USD | 90 | 19 working days | Get Quote |
| 5 mg | 57 USD | 90 | 19 working days | Get Quote |
| 10 mg | 71 USD | 90 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4680595689.sdf |
| SMILES | MCULE-4680595689.smiles |
| Standard InChI | MCULE-4680595689.inchi |
| InChIKey | MCULE-4680595689.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852189463 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-488555570 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-868144921 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-516409362 | Specs | Natural Products | 80 | As is | 1.058 g |
| P-869146775 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892303068 | TargetMol | Natural Products | 95 | As is | in stock |
| P-888649016 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-33162739 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1000 mg |
| P-594186558 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 13 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 369.410 |
| logP | 2.7837 |
| H-bond acceptors | 6 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 57.23 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 104.4135 |
| Atoms | 50 |
| Rings | 4 |
| Heavy atoms | 27 |
| Hydrogen atoms | 23 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
