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MCULE-9801596435-0
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 | 81 USD | 95 | 7 working days | Get Quote |
| 10 mg | 111 USD | 95 | 7 working days | Get Quote |
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1
MCULE-1066568953-1
- Component type: Main
-
2
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-9801596435-0.sdf |
| SMILES | MCULE-9801596435-0.smiles |
| Standard InChI | MCULE-9801596435-0.inchi |
| InChIKey | MCULE-9801596435-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867679949 | N/A | As is | in stock |
| P-874625468 | 97 | As is | by resynthesis (? - ? days) |
| P-893609968 | 90 | As is | 570 mg |
| P-1270333391 | 97 | As is | in stock |
| P-851757543 | N/A | As is | by synthesis |
| P-875891823 | 98 | As is | 30 mg |
| P-1273268195 | 95 | As is | by resynthesis (? - ? days) |
| P-864329335 | 95 | As is | by synthesis |
| P-878208964 | 95 | As is | 10 mg |
| P-869180304 | 95 | As is | in stock |
| P-904255717 | 95 | As is | unavailable |
| P-904228273 | 95 | As is | 248 mg |
| P-904243463 | 95 | As is | 248 mg |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 372.365 |
| logP | 1.94 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 8 |
| PSA | 80.26 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 94.595 |
| Atoms | 48 |
| Rings | 0 |
| Heavy atoms | 26 |
| Hydrogen atoms | 22 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 2 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 7 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 7 |
| Undefined stereo double bonds | 0 |
