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MCULE-6613157991
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 | 88 USD | 90 | 22 working days | Get Quote |
| 5 mg | 108 USD | 90 | 22 working days | Get Quote |
| 10 mg | 132 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6613157991.sdf |
| SMILES | MCULE-6613157991.smiles |
| Standard InChI | MCULE-6613157991.inchi |
| InChIKey | MCULE-6613157991.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-596315293 | Asinex | General screening catalog | 90 | As is | 59 mg |
| P-895140893 | ChemBridge | Core Library | 90 | As is | 5 mg |
| P-4982888 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 25 mg |
| P-3447863 | ChemDiv | Discovery Chemistry Library | 90 | As is | 59 mg |
| P-502762838 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-35173476 | Maybridge | Screening Collection | 90 | As is | 4.187 kg |
| P-631243065 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-902833880 | Specs | Natural Products | 80 | As is | 169 mg |
| P-13109307 | Specs | Screening Compounds | 90 | As is | 169 mg |
| P-903644145 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-23211977 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 4 mg |
| P-676483203 | Ultimate 3P | Express 1 | 90 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 305.300 |
| logP | 3.1768 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 56.79 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 80.0902 |
| Atoms | 38 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 16 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
