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UNKNOWN STEREO
MCULE-6944125658
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 | 27 USD | 95 | 7 working days | Get Quote |
| 5 mg | 56 USD | 95 | 7 working days | Get Quote |
| 10 mg | 85 USD | 95 | 7 working days | Get Quote |
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MCULE-8038463919
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6944125658.sdf |
| SMILES | MCULE-6944125658.smiles |
| Standard InChI | MCULE-6944125658.inchi |
| InChIKey | MCULE-6944125658.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-864232655 | 95 | As is | by synthesis |
| P-1271493254 | 95 | As is | by synthesis |
| P-881653431 | 98 | As a main component | in stock |
| P-905459865 | 95 | As a main component | in stock |
| P-901464958 | 95 | As a main component | by synthesis |
| P-892289766 | 95 | As a main component | unavailable |
| P-869121363 | 95 | As a main component | 87 mg |
| P-888636019 | 95 | As a main component | 73 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 387.598 |
| logP | 5.2453 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 29.54 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 117.02 |
| Atoms | 69 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 41 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
