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MCULE-5963813234
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 | 724 USD | 95 | 21 working days | Get Quote |
| 5 mg | 724 USD | 95 | 21 working days | Get Quote |
| 10 mg | 1250 USD | 95 | 21 working days | Get Quote |
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MCULE-9428812517
- Component type: Main
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MCULE-3093626251
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5963813234.sdf |
| SMILES | MCULE-5963813234.smiles |
| Standard InChI | MCULE-5963813234.inchi |
| InChIKey | MCULE-5963813234.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-584622590 | 95 | As is | in stock |
| P-1279690660 | 90 | As a main component | 50 mg |
| P-906838724 | 97 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 1210.429 |
| logP | 3.3212 |
| H-bond acceptors | 27 |
| H-bond donors | 14 |
| Rotatable bonds | 47 |
| PSA | 484.89 |
| RO5 violations | 3 |
| RO3 violations | 6 |
| Refractivity | 311.3564 |
| Atoms | 163 |
| Rings | 3 |
| Heavy atoms | 84 |
| Hydrogen atoms | 79 |
| Heteroatoms | 29 |
| N/O atoms | 27 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 9 |
| R/S chiral centers | 9 |
| 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 |
