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MCULE-7152493315
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 | 13 USD | 96 | 12 working days | Get Quote |
| 5 mg | 13 USD | 96 | 12 working days | Get Quote |
| 10 mg | 13 USD | 96 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7152493315.sdf |
| SMILES | MCULE-7152493315.smiles |
| Standard InChI | MCULE-7152493315.inchi |
| InChIKey | MCULE-7152493315.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-905479487 | 98 | As is | 1000 g |
| P-871219956 | N/A | As is | by resynthesis (? - ? days) |
| P-868599664 | 98 | As is | in stock |
| P-896532040 | 96 | As is | 281 g |
| P-861940826 | 96 | As is | 25 kg |
| P-854691336 | 95 | As is | in stock |
| P-899991334 | 95 | As is | by synthesis |
| P-584619137 | 95 | As is | in stock |
| P-878647070 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1297.123 |
| logP | -17.4064 |
| H-bond acceptors | 40 |
| H-bond donors | 24 |
| Rotatable bonds | 8 |
| PSA | 633.2 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 259.0672 |
| Atoms | 168 |
| Rings | 9 |
| Heavy atoms | 88 |
| Hydrogen atoms | 80 |
| Heteroatoms | 40 |
| N/O atoms | 40 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 40 |
| R/S chiral centers | 40 |
| 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 |
