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MCULE-4359905459
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 | 43 USD | 98 | 22 working days | Get Quote |
| 5 mg | 63 USD | 98 | 22 working days | Get Quote |
| 10 mg | 111 USD | 98 | 22 working days | Get Quote |
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MCULE-9540126969
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4359905459.sdf |
| SMILES | MCULE-4359905459.smiles |
| Standard InChI | MCULE-4359905459.inchi |
| InChIKey | MCULE-4359905459.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903174467 | 96 | As is | 100 mg |
| P-610957403 | 90 | As is | 765 mg |
| P-489243161 | 97 | As is | in stock |
| P-851247314 | 95 | As is | by synthesis |
| P-887238788 | 95 | As is | by synthesis |
| P-852522413 | N/A | As is | in stock |
| P-854715879 | 95 | As is | in stock |
| P-474027817 | 95 | As is | in stock |
| P-888171857 | 98 | As is | by synthesis |
| P-579711221 | N/A | As is | in stock |
| P-893364921 | 90 | As a main component | by synthesis |
| P-489210825 | 97 | As a main component | in stock |
| P-868958119 | 97 | As a main component | by synthesis |
| P-895199761 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 466.944 |
| logP | 4.8305 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 121.79 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 130.4514 |
| Atoms | 51 |
| Rings | 5 |
| Heavy atoms | 32 |
| Hydrogen atoms | 19 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
