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MCULE-4740586052
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 | 35 USD | 90 | 19 working days | Get Quote |
| 5 mg | 52 USD | 90 | 19 working days | Get Quote |
| 10 mg | 67 USD | 90 | 19 working days | Get Quote |
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1
MCULE-7513592387
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4740586052.sdf |
| SMILES | MCULE-4740586052.smiles |
| Standard InChI | MCULE-4740586052.inchi |
| InChIKey | MCULE-4740586052.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-35186628 | Maybridge | Screening Collection | 90 | As is | 4.924 kg |
| P-596335490 | Asinex | General screening catalog | 90 | Main component | 183 mg |
| P-5311850 | ChemDiv | Discovery Chemistry Library | 90 | Main component | 52 mg |
| P-12533944 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-31254099 | LaboTest | Screening Collection | 90 | Main component | 100 mg |
| P-35212667 | Maybridge | Screening Collection | 90 | Main component | 15.963 kg |
| P-13624670 | Pharmeks LLC | Synthetic compounds | 92 | Main component | 300 mg |
| P-22465084 | TimTec | ActiMol 1 Week - Stock | 90 | Main component | 296 mg |
| P-25629328 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component | 55 mg |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 394.716 |
| logP | 5.7148 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 20.31 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 112.062 |
| Atoms | 43 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 18 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
