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MCULE-2533658652
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 | 41 USD | 98 | 22 working days | Get Quote |
| 5 mg | 125 USD | 95 | 14 working days | Get Quote |
| 10 mg | 198 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2533658652.sdf |
| SMILES | MCULE-2533658652.smiles |
| Standard InChI | MCULE-2533658652.inchi |
| InChIKey | MCULE-2533658652.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-890230840 | 99 | As is | by synthesis |
| P-1274583917 | 95 | As is | by synthesis |
| P-863723954 | 95 | As is | in stock |
| P-867620744 | 98 | As an isomer | in stock |
| P-869347024 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-881622712 | N/A | As an isomer | by synthesis |
| P-888817844 | 99 | As an isomer | 10 mg |
| P-1274831949 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-889496399 | 95 | As an isomer | by synthesis |
| P-901459440 | 95 | As an isomer | by synthesis |
| P-1273110536 | 97 | As an isomer | 100 mg |
| P-869119634 | 95 | As an isomer | unavailable |
| P-888634522 | 95 | As an isomer | unavailable |
| P-855066299 | 90 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 396.561 |
| logP | 6.8148 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 46.53 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 123.5378 |
| Atoms | 65 |
| Rings | 2 |
| Heavy atoms | 29 |
| Hydrogen atoms | 36 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 3 |
| Cis/trans stereo double bonds | 3 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
