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MCULE-5819565181
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 | 28 USD | 98 | 16 working days | Get Quote |
| 5 mg | 28 USD | 98 | 16 working days | Get Quote |
| 10 mg | 30 USD | 95 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5819565181.sdf |
| SMILES | MCULE-5819565181.smiles |
| Standard InChI | MCULE-5819565181.inchi |
| InChIKey | MCULE-5819565181.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1264047023 | 95 | As is | in stock |
| P-1264049646 | 99 | As is | in stock |
| P-1264059549 | 98 | As is | in stock |
| P-500417888 | 97 | As is | in stock |
| P-596562280 | 95 | As is | 5 mg |
| P-608082095 | 98 | As is | in stock |
| P-608278931 | 98 | As is | in stock |
| P-885539871 | 95 | As is | by synthesis |
| P-1272978950 | 94 | As is | by resynthesis (? - ? days) |
| P-873005430 | 90 | As is | 100 mg |
| P-854967442 | 90 | As is | in stock |
| P-578064532 | 90 | As is | 1 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 853.903 |
| logP | 4.1266 |
| H-bond acceptors | 15 |
| H-bond donors | 4 |
| Rotatable bonds | 15 |
| PSA | 221.29 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 218.9591 |
| Atoms | 113 |
| Rings | 7 |
| Heavy atoms | 62 |
| Hydrogen atoms | 51 |
| Heteroatoms | 15 |
| N/O atoms | 15 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 11 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 11 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
