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MCULE-4561789282-0
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4561789282-0.sdf |
| SMILES | MCULE-4561789282-0.smiles |
| Standard InChI | MCULE-4561789282-0.inchi |
| InChIKey | MCULE-4561789282-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867412988 | N/A | As is | by synthesis |
| P-1274668314 | N/A | As is | by synthesis |
| P-454685187 | 90 | As is | in stock |
| P-15151520 | 90 | As is | 8 mg |
| P-436443399 | 90 | As is | 74.93 g |
| P-330316 | 90 | As is | 922 mg |
| P-34726646 | 90 | As is | by synthesis |
| P-580787960 | 90 | As is | by resynthesis (? - ? days) |
| P-488552951 | 90 | As is | in stock |
| P-12541414 | 92 | As is | 300 mg |
| P-596594577 | 90 | As is | 500 mg |
| P-869016097 | 95 | As is | by synthesis |
| P-454373185 | 92 | As is | in stock |
| P-23804995 | 92 | As is | 300 mg |
| P-491225812 | 95 | As is | by synthesis |
| P-24063608 | 90 | As is | in stock |
| P-453916881 | 90 | As is | 11 mg |
| P-22623119 | 90 | As is | in stock |
| P-502337488 | 90 | As is | in stock |
| P-1814386 | 90 | As is | 129 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 221.681 |
| logP | 3.191 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 36.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 61.9025 |
| Atoms | 27 |
| Rings | 3 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
