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MCULE-6236863261-0
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 | 94 USD | 90 | 18 working days | Get Quote |
| 5 mg | 112 USD | 90 | 18 working days | Get Quote |
| 10 mg | 124 USD | 90 | 18 working days | Get Quote |
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MCULE-4371950063-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6236863261-0.sdf |
| SMILES | MCULE-6236863261-0.smiles |
| Standard InChI | MCULE-6236863261-0.inchi |
| InChIKey | MCULE-6236863261-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886329322 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-675552810 | Innovapharm | Virtual Screening Compounds | 90 | As a main component | by synthesis |
| P-675444802 | Innovapharm | Screening Compounds | 90 | As a main component | in stock |
| P-25771984 | Life Chemicals | Screening Compounds | 90 | As a main component | 78 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 295.417 |
| logP | 2.9552 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 10 |
| PSA | 50.72 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 86.2115 |
| Atoms | 50 |
| Rings | 1 |
| Heavy atoms | 21 |
| Hydrogen atoms | 29 |
| 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 |
