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MCULE-1330857121
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 | 89 USD | 90 | 22 working days | Get Quote |
| 5 mg | 97 USD | 90 | 12 working days | Get Quote |
| 10 mg | 117 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1330857121.sdf |
| SMILES | MCULE-1330857121.smiles |
| Standard InChI | MCULE-1330857121.inchi |
| InChIKey | MCULE-1330857121.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886184358 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-505370324 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-578376153 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-9561243 | ChemDiv | Discovery Chemistry Library | 90 | As is | 70 mg |
| P-890207726 | HTS Biochemie Innovationen GmbH | Building Blocks | 90 | As is | in stock |
| P-579497529 | HTS Biochemie Innovationen GmbH | Stock Compounds | 90 | As is | in stock |
| P-131366864 | Life Chemicals | Screening Compounds | 90 | As is | 52 mg |
| P-859968008 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 343.398 |
| logP | 4.389 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 72.06 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 95.159 |
| Atoms | 41 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 17 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
