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MCULE-7845897386
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 | 92 | 18 working days | Get Quote |
| 5 mg | 43 USD | 92 | 18 working days | Get Quote |
| 10 mg | 54 USD | 92 | 18 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7845897386.sdf |
| SMILES | MCULE-7845897386.smiles |
| Standard InChI | MCULE-7845897386.inchi |
| InChIKey | MCULE-7845897386.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-596410514 | 90 | As is | 43 mg |
| P-504654038 | 85 | As is | 5 mg |
| P-13920861 | 92 | As is | 300 mg |
| P-13376932 | 92 | As is | 300 mg |
| P-19198196 | 90 | As is | in stock |
| P-12664033 | 90 | As is | 126 mg |
| P-869129205 | 95 | As is | unavailable |
| P-888641612 | 95 | As is | unavailable |
| P-22854788 | 90 | As is | in stock |
| P-888379932 | 94 | As is | by resynthesis (? - ? days) |
| P-931567 | 90 | As is | 651 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 337.325 |
| logP | 2.3656 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 84.86 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 93.0755 |
| Atoms | 40 |
| Rings | 4 |
| Heavy atoms | 25 |
| Hydrogen atoms | 15 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
