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UNKNOWN STEREO
MCULE-1602474627-0
Structure
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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 | 12 USD | 98 | 20 working days | Get Quote |
| 5 mg | 12 USD | 98 | 20 working days | Get Quote |
| 10 mg | 12 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1602474627-0.sdf |
| SMILES | MCULE-1602474627-0.smiles |
| Standard InChI | MCULE-1602474627-0.inchi |
| InChIKey | MCULE-1602474627-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867550330 | 99 | As is | in stock |
| P-875707879 | 99 | As is | in stock |
| P-1275180377 | 98 | As is | in stock |
| P-1275177834 | 98 | As is | in stock |
| P-596941171 | 98 | As is | 2 g |
| P-864105821 | 95 | As is | in stock |
| P-893218991 | 95 | As is | in stock |
| P-893227523 | 95 | As is | in stock |
| P-488555537 | 92 | As is | in stock |
| P-488545498 | 90 | As is | in stock |
| P-454365738 | 92 | As is | in stock |
| P-869118705 | 95 | As is | 1000 mg |
| P-892288900 | 95 | As is | 1000 mg |
| P-888633735 | 95 | As is | 1000 mg |
| P-611352343 | 90 | As is | in stock |
| P-855295916 | 90 | As is | in stock |
| P-575295752 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 528.528 |
| logP | 6.9779 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 58.2 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 129.9444 |
| Atoms | 67 |
| Rings | 5 |
| Heavy atoms | 37 |
| Hydrogen atoms | 30 |
| Heteroatoms | 10 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| Chiral centers | 7 |
| R/S chiral centers | 7 |
| 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 |
