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MCULE-6694291034
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.
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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 | 33 USD | 97 | 11 working days | Get Quote |
| 5 mg | 33 USD | 97 | 11 working days | Get Quote |
| 10 mg | 33 USD | 97 | 11 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-8171747888
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6694291034.sdf |
| SMILES | MCULE-6694291034.smiles |
| Standard InChI | MCULE-6694291034.inchi |
| InChIKey | MCULE-6694291034.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-597026262 | AEchem | Building blocks | 95 | As is | in stock |
| P-591031485 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-868629515 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-493673778 | Iris Biotech GmbH | Building Block Library | N/A | As is | in stock |
| P-854829993 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-616195413 | BLD pharm | Non-stock building blocks | 95 | As a main component | by synthesis |
| P-870584910 | Combi-Blocks | Building Block in stock | 97 | As a main component | in stock |
| P-854829992 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 456.559 |
| logP | 4.5258 |
| H-bond acceptors | 10 |
| H-bond donors | 4 |
| Rotatable bonds | 12 |
| PSA | 168.56 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 117.9836 |
| Atoms | 63 |
| Rings | 1 |
| Heavy atoms | 31 |
| Hydrogen atoms | 32 |
| Heteroatoms | 11 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
