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MCULE-9771102327
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 | 63 USD | 95 | 14 working days | Get Quote |
| 5 mg | 131 USD | 98 | 16 working days | Get Quote |
| 10 mg | 161 USD | N/A | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9771102327.sdf |
| SMILES | MCULE-9771102327.smiles |
| Standard InChI | MCULE-9771102327.inchi |
| InChIKey | MCULE-9771102327.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893604670 | 90 | As is | 12.436 g |
| P-851316245 | 95 | As is | by synthesis |
| P-896544180 | 97 | As is | in stock |
| P-608495364 | 95 | As is | in stock |
| P-854621324 | 98 | As is | in stock |
| P-905437538 | N/A | As is | 1.81 g |
| P-854713236 | 95 | As is | in stock |
| P-871072187 | 95 | As is | in stock |
| P-878642308 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1002.641 |
| logP | 6.1428 |
| H-bond acceptors | 17 |
| H-bond donors | 4 |
| Rotatable bonds | 25 |
| PSA | 267.97 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 272.8339 |
| Atoms | 129 |
| Rings | 7 |
| Heavy atoms | 69 |
| Hydrogen atoms | 60 |
| Heteroatoms | 20 |
| N/O atoms | 17 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
