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MCULE-9125400451-0
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 | 12 working days | Get Quote |
| 5 mg | 108 USD | 95 | 12 working days | Get Quote |
| 10 mg | 176 USD | 95 | 12 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9125400451-0.sdf |
| SMILES | MCULE-9125400451-0.smiles |
| Standard InChI | MCULE-9125400451-0.inchi |
| InChIKey | MCULE-9125400451-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867632435 | 95 | As is | in stock |
| P-875796972 | 95 | As is | in stock |
| P-1275159677 | 98 | As is | in stock |
| P-869300728 | 95 | As is | by resynthesis (? - ? days) |
| P-904320334 | 90 | As is | 5.776 g |
| P-891653964 | N/A | As is | by synthesis |
| P-895100462 | N/A | As is | 100 mg |
| P-1273266070 | 95 | As is | by resynthesis (? - ? days) |
| P-889522669 | 95 | As is | by synthesis |
| P-590813313 | 95 | As is | by synthesis |
| P-901428548 | 95 | As is | by synthesis |
| P-887183648 | 95 | As is | by synthesis |
| P-500229312 | N/A | As is | in stock |
| P-524166505 | 95 | As is | unavailable |
| P-872528750 | 95 | As is | in stock |
| P-1267008119 | 95 | As is | by synthesis |
| P-584620289 | 95 | As is | in stock |
| P-888173477 | 98 | As is | by synthesis |
| P-904245857 | 95 | As is | unavailable |
| P-869119493 | 95 | As is | 477 mg |
| P-888634409 | 95 | As is | 477 mg |
| P-1271598553 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 423.572 |
| logP | 5.5946 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 9 |
| PSA | 110.7 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 116.4011 |
| Atoms | 54 |
| Rings | 2 |
| Heavy atoms | 28 |
| Hydrogen atoms | 26 |
| Heteroatoms | 8 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
