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MCULE-7652870800-0
Structure
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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 | 95 | 7 working days | Get Quote |
| 5 mg | 85 USD | 95 | 7 working days | Get Quote |
| 10 mg | 131 USD | 95 | 7 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-7652870800-0.sdf |
| SMILES | MCULE-7652870800-0.smiles |
| Standard InChI | MCULE-7652870800-0.inchi |
| InChIKey | MCULE-7652870800-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867681272 | N/A | As is | in stock |
| P-875858094 | 98 | As is | in stock |
| P-869358045 | 95 | As is | by resynthesis (? - ? days) |
| P-893605300 | 90 | As is | 1.284 g |
| P-851703940 | N/A | As is | by synthesis |
| P-895106640 | N/A | As is | 200 mg |
| P-1273261572 | 95 | As is | by resynthesis (? - ? days) |
| P-889522418 | 95 | As is | by synthesis |
| P-619595995 | 99 | As is | by synthesis |
| P-873247664 | 97 | As is | 5 mg |
| P-863725586 | 95 | As is | in stock |
| P-871070607 | 95 | As is | in stock |
| P-904082924 | 98 | As is | 3.1 g |
| P-892287679 | 95 | As is | unavailable |
| P-869111051 | 95 | As is | 105 mg |
| P-888629101 | 95 | As is | 105 mg |
| P-1271618289 | 99 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 438.520 |
| logP | 5.2376 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 71.25 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 132.0918 |
| Atoms | 59 |
| Rings | 5 |
| Heavy atoms | 33 |
| Hydrogen atoms | 26 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 |
