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MCULE-5348575056
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.
|
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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| Name | File |
|---|---|
| SDF | MCULE-5348575056.sdf |
| SMILES | MCULE-5348575056.smiles |
| Standard InChI | MCULE-5348575056.inchi |
| InChIKey | MCULE-5348575056.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867417194 | N/A | As is | by synthesis |
| P-596283784 | 90 | As is | 93 mg |
| P-619929213 | 90 | As is | by synthesis |
| P-502594957 | 90 | As is | in stock |
| P-596585854 | 90 | As is | 5 g |
| P-12513190 | 90 | As is | 50 mg |
| P-885517794 | 95 | As is | by synthesis |
| P-18833964 | 90 | As is | in stock |
| P-502349788 | 90 | As is | in stock |
| P-888357315 | 94 | As is | by resynthesis (? - ? days) |
| P-2158528 | 90 | As is | 5.076 g |
| P-3215763 | 90 | As is | 5.076 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 279.746 |
| logP | 3.8583 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 95.64 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 75.9121 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| 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 | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
