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MCULE-4749670213
Compound
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- InChIKey:
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- 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 | 34 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 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-4749670213.sdf |
| SMILES | MCULE-4749670213.smiles |
| Standard InChI | MCULE-4749670213.inchi |
| InChIKey | MCULE-4749670213.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-425299381 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-4145801 | ChemDiv | Discovery Chemistry Library | 90 | As is | 75 mg |
| P-502731749 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-12715214 | InterBioScreen | Screening Compounds | 92 | As is | unavailable |
| P-651005852 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-12820317 | Otava | In-House Stock Library | 90 | As is | 68 mg |
| P-13951501 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-424808682 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-33868933 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
| P-2407055 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 106 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 461.944 |
| logP | 3.8178 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 156.13 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 123.3989 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 16 |
| Heteroatoms | 10 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
