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MCULE-4799589864-0
Structure
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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 | 90 | 21 working days | Get Quote |
| 5 mg | 69 USD | 90 | 21 working days | Get Quote |
| 10 mg | 81 USD | 90 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4799589864-0.sdf |
| SMILES | MCULE-4799589864-0.smiles |
| Standard InChI | MCULE-4799589864-0.inchi |
| InChIKey | MCULE-4799589864-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886773315 | 95 | As is | in stock |
| P-890065781 | 90 | As is | by synthesis |
| P-1264782862 | 95 | As is | 1000 mg |
| P-904764721 | N/A | As is | by synthesis |
| P-905583775 | 95 | As is | by synthesis |
| P-890221291 | 90 | As is | in stock |
| P-855380030 | 90 | As is | 110 mg |
| P-895589330 | 95 | As is | by synthesis |
| P-859998928 | 95 | As is | by synthesis |
| P-893779818 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 216.217 |
| logP | 1.3051 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 104.74 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 49.466 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
