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MCULE-4491597294-0
Structure
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- InChIKey:
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- InChI:
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| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
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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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
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MCULE-3808792368-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4491597294-0.sdf |
| SMILES | MCULE-4491597294-0.smiles |
| Standard InChI | MCULE-4491597294-0.inchi |
| InChIKey | MCULE-4491597294-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-6305750 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 50 mg |
| P-577209369 | ChemDiv | Discovery Chemistry Library | 90 | As is | 10 mg |
| P-617929164 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-19121690 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-872072 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 475 mg |
| P-34559079 | Crea-Chim | HTS compounds | 90 | As a main component | by resynthesis (? - ? days) |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 395.469 |
| logP | 2.9675 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 5 |
| PSA | 43.86 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 121.3075 |
| Atoms | 55 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 26 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
