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MCULE-4069595459
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 | 40 USD | 95 | 12 working days | Get Quote |
| 5 mg | 60 USD | 98 | 22 working days | Get Quote |
| 10 mg | 60 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4069595459.sdf |
| SMILES | MCULE-4069595459.smiles |
| Standard InChI | MCULE-4069595459.inchi |
| InChIKey | MCULE-4069595459.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867624446 | 98 | As is | in stock |
| P-875786725 | 98 | As is | in stock |
| P-869374523 | 95 | As is | by resynthesis (? - ? days) |
| P-903136547 | 98 | As is | 200 mg |
| P-1270303092 | 97 | As is | in stock |
| P-1264203666 | N/A | As is | by synthesis |
| P-895099217 | 98 | As is | 200 mg |
| P-1273404026 | 95 | As is | by resynthesis (? - ? days) |
| P-889785498 | 95 | As is | in stock |
| P-866712658 | 99 | As is | by synthesis |
| P-873244318 | 97 | As is | 1 mg |
| P-872798170 | 95 | As is | in stock |
| P-1274333639 | 95 | As is | unavailable |
| P-869129080 | 95 | As is | 192 mg |
| P-888641531 | 95 | As is | 190 mg |
| P-611464669 | 90 | As is | in stock |
| P-886893615 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 337.800 |
| logP | 4.7454 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 54.02 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 97.2539 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 24 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
