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MCULE-1115340556-0
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 | 110 USD | 90 | 20 working days | Get Quote |
| 5 mg | 110 USD | 90 | 20 working days | Get Quote |
| 10 mg | 110 USD | 90 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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2
MCULE-7934637937-0
- Component type: Main
-
1
MCULE-1504889908-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1115340556-0.sdf |
| SMILES | MCULE-1115340556-0.smiles |
| Standard InChI | MCULE-1115340556-0.inchi |
| InChIKey | MCULE-1115340556-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-31151835 | LaboTest | Screening Collection | 90 | As is | 100 mg |
| P-13270430 | Pharmeks LLC | Synthetic compounds | 92 | Main component as a main component | 300 mg |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 594.729 |
| logP | -1.0178 |
| H-bond acceptors | 14 |
| H-bond donors | 8 |
| Rotatable bonds | 10 |
| PSA | 262.86 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 163.7074 |
| Atoms | 83 |
| Rings | 4 |
| Heavy atoms | 41 |
| Hydrogen atoms | 42 |
| Heteroatoms | 15 |
| N/O atoms | 14 |
| 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 |
