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MCULE-1409269801
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 | 57 USD | 95 | 13 working days | Get Quote |
| 5 mg | 115 USD | 95 | 14 working days | Get Quote |
| 10 mg | 183 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1409269801.sdf |
| SMILES | MCULE-1409269801.smiles |
| Standard InChI | MCULE-1409269801.inchi |
| InChIKey | MCULE-1409269801.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-610960944 | 90 | As is | 1.22 g |
| P-900154786 | 95 | As is | in stock |
| P-871219455 | N/A | As is | by resynthesis (? - ? days) |
| P-861488348 | 95 | As is | by synthesis |
| P-579480002 | 95 | As is | in stock |
| P-854712628 | 95 | As is | in stock |
| P-896628698 | 95 | As is | by synthesis |
| P-870132559 | 97 | As is | in stock |
| P-617405030 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 723.642 |
| logP | 2.8531 |
| H-bond acceptors | 14 |
| H-bond donors | 5 |
| Rotatable bonds | 13 |
| PSA | 215.22 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 166.9193 |
| Atoms | 87 |
| Rings | 5 |
| Heavy atoms | 51 |
| Hydrogen atoms | 36 |
| Heteroatoms | 17 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 |
