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MCULE-4522193885
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 | 30 USD | 98 | 16 working days | Get Quote |
| 5 mg | 30 USD | 98 | 16 working days | Get Quote |
| 10 mg | 46 USD | 98 | 11 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4522193885.sdf |
| SMILES | MCULE-4522193885.smiles |
| Standard InChI | MCULE-4522193885.inchi |
| InChIKey | MCULE-4522193885.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903212158 | 98 | As is | 500 mg |
| P-25940535 | 70 | As is | 2 mg |
| P-890243824 | 98 | As is | 2.11 g |
| P-900267990 | N/A | As is | by resynthesis (? - ? days) |
| P-452653115 | 98 | As is | in stock |
| P-903004448 | 98 | As is | in stock |
| P-854691606 | 95 | As is | in stock |
| P-584619129 | 95 | As is | in stock |
| P-619672354 | 98 | As is | in stock |
| P-617404519 | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 306.266 |
| logP | 1.2517 |
| H-bond acceptors | 7 |
| H-bond donors | 6 |
| Rotatable bonds | 1 |
| PSA | 130.61 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 76.3568 |
| Atoms | 36 |
| Rings | 3 |
| Heavy atoms | 22 |
| Hydrogen atoms | 14 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
