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MCULE-1128487802
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 | 38 USD | 95 | 7 working days | Get Quote |
| 5 mg | 81 USD | N/A | 9 working days | Get Quote |
| 10 mg | 121 USD | N/A | 9 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1128487802.sdf |
| SMILES | MCULE-1128487802.smiles |
| Standard InChI | MCULE-1128487802.inchi |
| InChIKey | MCULE-1128487802.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867604101 | 95 | As is | in stock |
| P-869306551 | 95 | As is | in stock |
| P-904320337 | 90 | As is | 3.235 g |
| P-893291353 | N/A | As is | in stock |
| P-895095704 | 98 | As is | 50 mg |
| P-872726340 | 98 | As is | in stock |
| P-889521391 | 95 | As is | by synthesis |
| P-901542928 | 95 | As is | by synthesis |
| P-870660328 | 99 | As is | in stock |
| P-873250511 | 97 | As is | 10 mg |
| P-869119560 | 95 | As is | by synthesis |
| P-904245881 | 95 | As is | unavailable |
| P-888634465 | 95 | As is | 100 mg |
| P-596714745 | 90 | As is | 10 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 536.438 |
| logP | 7.1917 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 8 |
| PSA | 80.85 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 138.1077 |
| Atoms | 56 |
| Rings | 4 |
| Heavy atoms | 34 |
| Hydrogen atoms | 22 |
| Heteroatoms | 7 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
