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MCULE-5999058072
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 | 47 USD | 90 | 22 working days | Get Quote |
| 5 mg | 69 USD | 90 | 22 working days | Get Quote |
| 10 mg | 87 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5999058072.sdf |
| SMILES | MCULE-5999058072.smiles |
| Standard InChI | MCULE-5999058072.inchi |
| InChIKey | MCULE-5999058072.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-885951666 | N/A | As is | by synthesis |
| P-3433846 | 90 | As is | 127 mg |
| P-425220797 | 90 | As is | in stock |
| P-502468996 | 95 | As is | by synthesis |
| P-502747013 | 90 | As is | in stock |
| P-617697667 | 90 | As is | 1.076 g |
| P-12826880 | 90 | As is | 1.076 g |
| P-19453912 | 90 | As is | in stock |
| P-23409619 | 90 | As is | 28 mg |
| P-33890057 | 90 | As is | in stock |
| P-502338410 | 90 | As is | in stock |
| P-873216807 | 90 | As is | in stock |
| P-903626967 | 94 | As is | by resynthesis (? - ? days) |
| P-903623085 | 94 | As is | by resynthesis (? - ? days) |
| P-1307794 | 90 | As is | 25 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 258.141 |
| logP | 2.7074 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 82.5 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.9001 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 5 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
