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MCULE-6728755459
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 | 33 USD | 90 | 19 working days | Get Quote |
| 5 mg | 35 USD | 90 | 17 working days | Get Quote |
| 10 mg | 41 USD | 90 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6728755459.sdf |
| SMILES | MCULE-6728755459.smiles |
| Standard InChI | MCULE-6728755459.inchi |
| InChIKey | MCULE-6728755459.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-34879005 | Alinda | Stock Screening Compounds | 90 | As is | in stock |
| P-596594265 | Key Organics | Building Blocks | 90 | As is | 500 mg |
| P-856066276 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 4 g |
| P-18827480 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-453941438 | Specs | Screening Compounds | 90 | As is | 11 mg |
| P-33307822 | TimTec | ActiMol 2 Week | 90 | As is | in stock |
| P-888578548 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-1826977 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-464682594 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 362.402 |
| logP | 3.1639 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 120.95 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 92.5232 |
| Atoms | 43 |
| Rings | 2 |
| Heavy atoms | 25 |
| Hydrogen atoms | 18 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
