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UNKNOWN STEREO
MCULE-6198072773
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 | 11 USD | 96 | 20 working days | Get Quote |
| 5 mg | 11 USD | 96 | 20 working days | Get Quote |
| 10 mg | 11 USD | 96 | 20 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-6198072773.sdf |
| SMILES | MCULE-6198072773.smiles |
| Standard InChI | MCULE-6198072773.inchi |
| InChIKey | MCULE-6198072773.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867666777 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-596973942 | Angene | Building Blocks in stock | 96 | As is | 2.185 kg |
| P-580193440 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864142053 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868545883 | Axon Medchem | Axon predominantly SC catalog | 98 | As is | in stock |
| P-488556202 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-500392546 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-854963740 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 665.724 |
| logP | 0.82 |
| H-bond acceptors | 14 |
| H-bond donors | 7 |
| Rotatable bonds | 3 |
| PSA | 230.99 |
| RO5 violations | 3 |
| RO3 violations | 4 |
| Refractivity | 165.8702 |
| Atoms | 94 |
| Rings | 4 |
| Heavy atoms | 47 |
| Hydrogen atoms | 47 |
| Heteroatoms | 14 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 14 |
| R/S chiral centers | 14 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 5 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 5 |
| Undefined stereo double bonds | 0 |
