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MCULE-7857189389-0
Structure
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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.
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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 | 108 USD | 98 | 24 working days | Get Quote |
| 5 mg | 108 USD | 98 | 24 working days | Get Quote |
| 10 mg | 108 USD | 98 | 24 working days | Get Quote |
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1
MCULE-2885245608-2
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-7857189389-0.sdf |
| SMILES | MCULE-7857189389-0.smiles |
| Standard InChI | MCULE-7857189389-0.inchi |
| InChIKey | MCULE-7857189389-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867643506 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875809969 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505391677 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-851668567 | AmBeed | On request | N/A | As is | by synthesis |
| P-591094008 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-868592747 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-524165323 | Key Organics | Building Blocks | 98 | As is | 1000 mg |
| P-892254668 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892339298 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 288.802 |
| logP | 2.18118 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 7 |
| PSA | 114.19 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 76.1481 |
| Atoms | 35 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 17 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
