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MCULE-3531785598
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 | 21 USD | 98 | 12 working days | Get Quote |
| 5 mg | 21 USD | 98 | 12 working days | Get Quote |
| 10 mg | 36 USD | 98 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3531785598.sdf |
| SMILES | MCULE-3531785598.smiles |
| Standard InChI | MCULE-3531785598.inchi |
| InChIKey | MCULE-3531785598.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875868640 | 98 | As is | in stock |
| P-874610613 | 98 | As is | by resynthesis (? - ? days) |
| P-1264054693 | 95 | As is | in stock |
| P-893573063 | 90 | As is | 7.337 g |
| P-1270346831 | 98 | As is | in stock |
| P-851946443 | N/A | As is | in stock |
| P-865935147 | 98 | As is | 200 mg |
| P-1273451282 | 95 | As is | by resynthesis (? - ? days) |
| P-864191816 | 95 | As is | in stock |
| P-907573470 | 98 | As is | by synthesis |
| P-611004415 | 98 | As is | 475 mg |
| P-901449273 | 95 | As is | by synthesis |
| P-861286814 | 98 | As is | in stock |
| P-861379779 | 95 | As is | by synthesis |
| P-868658926 | 95 | As is | in stock |
| P-854621948 | 98 | As is | in stock |
| P-889437221 | 98 | As is | 750 mg |
| P-855916773 | 97 | As is | 100 mg |
| P-854715949 | 95 | As is | in stock |
| P-888172808 | 98 | As is | by synthesis |
| P-1271691037 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 386.754 |
| logP | 2.2938 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 69.3 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 95.8167 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 14 |
| Heteroatoms | 10 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 4 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
