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MCULE-3330850494
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 | 30 USD | 95 | 20 working days | Get Quote |
| 5 mg | 30 USD | 95 | 20 working days | Get Quote |
| 10 mg | 30 USD | 95 | 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-3330850494.sdf |
| SMILES | MCULE-3330850494.smiles |
| Standard InChI | MCULE-3330850494.inchi |
| InChIKey | MCULE-3330850494.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-904730560 | N/A | As is | in stock |
| P-900249862 | 95 | As is | 50 g |
| P-872723665 | 98 | As is | in stock |
| P-872723670 | 98 | As is | in stock |
| P-904994925 | 98 | As is | 55.9 g |
| P-893228926 | 95 | As is | in stock |
| P-893232808 | 95 | As is | in stock |
| P-1263264632 | 95 | As is | by synthesis |
| P-500417515 | 99 | As is | in stock |
| P-870647661 | N/A | As is | in stock |
| P-905626093 | 98 | As is | 100 g |
| P-31196988 | 90 | As is | 500 mg |
| P-904073908 | 95 | As is | in stock |
| P-885541638 | 95 | As is | by synthesis |
| P-19518939 | 90 | As is | in stock |
| P-33714276 | 94 | As is | by resynthesis (? - ? days) |
| P-906777606 | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 468.541 |
| logP | 5.4551 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 14 |
| PSA | 113.96 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 128.1412 |
| Atoms | 66 |
| Rings | 3 |
| Heavy atoms | 34 |
| Hydrogen atoms | 32 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
