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MCULE-3503788133
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.
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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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-4667424750
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3503788133.sdf |
| SMILES | MCULE-3503788133.smiles |
| Standard InChI | MCULE-3503788133.inchi |
| InChIKey | MCULE-3503788133.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-619327189 | ChemDiv | Discovery Chemistry Library | 90 | As is | 31 mg |
| P-617602172 | Specs | Screening Compounds | 90 | As is | 87 mg |
| P-19133899 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-1409567 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 207 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 467.823 |
| logP | 4.5856 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 11 |
| PSA | 79.82 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 114.1682 |
| Atoms | 59 |
| Rings | 1 |
| Heavy atoms | 27 |
| Hydrogen atoms | 32 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
