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MCULE-5987859399
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 | 31 USD | 95 | 8 working days | Get Quote |
| 5 mg | 31 USD | 95 | 8 working days | Get Quote |
| 10 mg | 31 USD | 95 | 8 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5987859399.sdf |
| SMILES | MCULE-5987859399.smiles |
| Standard InChI | MCULE-5987859399.inchi |
| InChIKey | MCULE-5987859399.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875768991 | N/A | As is | in stock |
| P-869303306 | 95 | As is | in stock |
| P-903108243 | 97 | As is | 50 g |
| P-893571491 | 90 | As is | 91 g |
| P-606931218 | N/A | As is | in stock |
| P-619155340 | 95 | As is | 50 g |
| P-864181305 | 95 | As is | in stock |
| P-611004795 | 95 | As is | 5.35 g |
| P-893228764 | 95 | As is | in stock |
| P-619929881 | 90 | As is | by synthesis |
| P-851326292 | 95 | As is | by synthesis |
| P-868563973 | 98 | As is | in stock |
| P-855913510 | 95 | As is | 250 mg |
| P-854801153 | 95 | As is | by synthesis |
| P-888884866 | N/A | As is | in stock |
| P-889862693 | 95 | As is | by synthesis |
| P-519904973 | 90 | As is | in stock |
| P-579708597 | N/A | As is | in stock |
| P-611415908 | 90 | As is | in stock |
| P-3180212 | 90 | As is | 1.397 g |
| P-667021082 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 222.280 |
| logP | 3.3372 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 64.5843 |
| Atoms | 34 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 18 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
