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MCULE-3972180335
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 | 17 USD | 90 | 18 working days | Get Quote |
| 5 mg | 17 USD | 90 | 18 working days | Get Quote |
| 10 mg | 17 USD | 90 | 18 working days | Get Quote |
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1
MCULE-4931662363
- Component type: Main
-
2
MCULE-3833394421
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-3972180335.sdf |
| SMILES | MCULE-3972180335.smiles |
| Standard InChI | MCULE-3972180335.inchi |
| InChIKey | MCULE-3972180335.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1275190419 | 98 | As is | in stock |
| P-1275146525 | 90 | As is | in stock |
| P-1275159779 | 98 | As is | in stock |
| P-1270337676 | 85 | As is | in stock |
| P-851940115 | N/A | As is | in stock |
| P-1274792562 | 95 | As is | 225 g |
| P-1273456738 | 95 | As is | by resynthesis (? - ? days) |
| P-864182403 | 85 | As is | in stock |
| P-893221480 | 95 | As is | in stock |
| P-870662664 | 80 | As is | in stock |
| P-906769386 | 99 | As is | by synthesis |
| P-854978971 | 90 | As is | in stock |
| P-1271671519 | 85 | As is | in stock |
| Property | Value |
|---|---|
| Components | 3 |
| Mass | 496.426 |
| logP | 5.2476 |
| H-bond acceptors | 10 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 185.34 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 104.0618 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 32 |
| Hydrogen atoms | 14 |
| Heteroatoms | 14 |
| N/O atoms | 10 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
