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MCULE-1561231965-0
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.
|
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 | 159 USD | 95 | 19 working days | Get Quote |
| 5 mg | 159 USD | 95 | 19 working days | Get Quote |
| 10 mg | 159 USD | 95 | 19 working days | Get Quote |
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1
MCULE-9976402631-1
- Component type: Counter Ion
-
1
MCULE-1379281060-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-1561231965-0.sdf |
| SMILES | MCULE-1561231965-0.smiles |
| Standard InChI | MCULE-1561231965-0.inchi |
| InChIKey | MCULE-1561231965-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869219157 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-889852668 | LumTec | All | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 145.081 |
| logP | 0.9085 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 23.3192 |
| Atoms | 15 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| Heteroatoms | 6 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
