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MCULE-9960111669-0
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 | 40 USD | 90 | 22 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 working days | Get Quote |
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1
MCULE-7981253226-2
- Component type: Counter Ion
-
1
MCULE-2373499303-0
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-9960111669-0.sdf |
| SMILES | MCULE-9960111669-0.smiles |
| Standard InChI | MCULE-9960111669-0.inchi |
| InChIKey | MCULE-9960111669-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-885522385 | 95 | As is | by synthesis |
| P-19539443 | 90 | As is | in stock |
| P-22899874 | 90 | As is | in stock |
| P-3215995 | 90 | As is | 59.509 g |
| P-1284877 | 90 | As is | 59.509 g |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 397.307 |
| logP | -4.2987 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 137.79 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 39.3406 |
| Atoms | 20 |
| Rings | 0 |
| Heavy atoms | 14 |
| Hydrogen atoms | 6 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 1 |
| 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 |
