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MCULE-2904970563
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 | 17 USD | 98 | 11 working days | Get Quote |
| 5 mg | 17 USD | 98 | 11 working days | Get Quote |
| 10 mg | 17 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2904970563.sdf |
| SMILES | MCULE-2904970563.smiles |
| Standard InChI | MCULE-2904970563.inchi |
| InChIKey | MCULE-2904970563.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893524315 | 90 | As is | in stock |
| P-489240678 | 97 | As is | in stock |
| P-500414353 | 95 | As is | by synthesis |
| P-900154668 | 95 | As is | in stock |
| P-901917788 | 99 | As is | 1.131 g |
| P-900268009 | N/A | As is | by resynthesis (? - ? days) |
| P-852001208 | 98 | As is | in stock |
| P-905259905 | 95 | As is | by synthesis |
| P-579477878 | 95 | As is | in stock |
| P-1275597421 | 95 | As is | in stock |
| P-854693605 | 95 | As is | in stock |
| P-474023683 | 95 | As is | in stock |
| P-608280050 | 98 | As is | in stock |
| P-617404515 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 785.012 |
| logP | 2.149 |
| H-bond acceptors | 13 |
| H-bond donors | 9 |
| Rotatable bonds | 10 |
| PSA | 218.99 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 204.6442 |
| Atoms | 127 |
| Rings | 6 |
| Heavy atoms | 55 |
| Hydrogen atoms | 72 |
| Heteroatoms | 13 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 20 |
| R/S chiral centers | 20 |
| 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 |
