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MCULE-7387668006
Compound
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- InChIKey:
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- 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 | 67 USD | 90 | 10 working days | Get Quote |
| 5 mg | 83 USD | 90 | 10 working days | Get Quote |
| 10 mg | 114 USD | 90 | 10 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-7387668006.sdf |
| SMILES | MCULE-7387668006.smiles |
| Standard InChI | MCULE-7387668006.inchi |
| InChIKey | MCULE-7387668006.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852133014 | A2B Chem | Predominantly Building Block on demand | 90 | As is | by synthesis |
| P-875842015 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-454408825 | Key Organics | Building Blocks | 90 | As is | 5.337 g |
| P-18707444 | Key Organics | Screening Compounds and Fragments | 90 | As is | 5.337 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 301.354 |
| logP | 2.3317 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 32.7 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 86.7148 |
| Atoms | 42 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 20 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
