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MCULE-5281659775
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 | 98 | 15 working days | Get Quote |
| 5 mg | 37 USD | 98 | 15 working days | Get Quote |
| 10 mg | 61 USD | 98 | 15 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-5281659775.sdf |
| SMILES | MCULE-5281659775.smiles |
| Standard InChI | MCULE-5281659775.inchi |
| InChIKey | MCULE-5281659775.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903060024 | 98 | As is | 100 mg |
| P-1264047071 | 95 | As is | in stock |
| P-610959321 | 90 | As is | 10.337 g |
| P-489109934 | 97 | As is | in stock |
| P-580719328 | 98 | As is | 1.083 g |
| P-881634000 | 98 | As is | in stock |
| P-851249232 | 95 | As is | by synthesis |
| P-861367321 | 95 | As is | by synthesis |
| P-579480096 | 95 | As is | in stock |
| P-579691100 | 95 | As is | by resynthesis (? - ? days) |
| P-852503543 | N/A | As is | in stock |
| P-854712737 | 95 | As is | in stock |
| P-474026401 | 95 | As is | in stock |
| P-608277240 | 98 | As is | in stock |
| P-579710280 | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 469.403 |
| logP | 4.7228 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 87.3 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 111.7011 |
| Atoms | 53 |
| Rings | 3 |
| Heavy atoms | 33 |
| Hydrogen atoms | 20 |
| Heteroatoms | 11 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
