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MCULE-2816821587
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 | 70 USD | 90 | 22 working days | Get Quote |
| 5 mg | 102 USD | 90 | 22 working days | Get Quote |
| 10 mg | 130 USD | 92 | 18 working days | Get Quote |
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1
MCULE-3611191528
- Component type: Main
-
1
MCULE-6647815245
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-2816821587.sdf |
| SMILES | MCULE-2816821587.smiles |
| Standard InChI | MCULE-2816821587.inchi |
| InChIKey | MCULE-2816821587.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-34560649 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
| P-24190201 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-13474763 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-596488878 | Asinex | General bb catalog | 90 | Main component | 1 mg |
| P-596341487 | Asinex | General screening catalog | 90 | Main component | 1 mg |
| P-4943722 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 10 mg |
| P-626788191 | Otava | Tangible screening compounds | 90 | Main component | by synthesis |
| P-676469232 | Ultimate 3P | Express 1 | 90 | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 372.375 |
| logP | -0.6545 |
| H-bond acceptors | 9 |
| H-bond donors | 2 |
| Rotatable bonds | 5 |
| PSA | 127.96 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 101.7415 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 27 |
| Hydrogen atoms | 20 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 |
