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UNKNOWN STEREO
MCULE-3473816652
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 | 38 USD | 98 | 22 working days | Get Quote |
| 5 mg | 90 USD | 98 | 22 working days | Get Quote |
| 10 mg | 132 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3473816652.sdf |
| SMILES | MCULE-3473816652.smiles |
| Standard InChI | MCULE-3473816652.inchi |
| InChIKey | MCULE-3473816652.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867679942 | 98 | As is | in stock |
| P-875858729 | 95 | As is | in stock |
| P-892787615 | 95 | As is | by resynthesis (? - ? days) |
| P-1270301153 | 98 | As is | in stock |
| P-888731552 | N/A | As is | in stock |
| P-895106357 | 98 | As is | 500 mg |
| P-889777549 | 95 | As is | in stock |
| P-675215213 | 95 | As is | in stock |
| P-869119183 | 95 | As is | 462 mg |
| P-892289082 | 95 | As is | 449 mg |
| P-888634133 | 95 | As is | 449 mg |
| P-1271285367 | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 407.371 |
| logP | 2.6568 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 111.71 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 101.5481 |
| Atoms | 48 |
| Rings | 4 |
| Heavy atoms | 29 |
| Hydrogen atoms | 19 |
| Heteroatoms | 11 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
