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MCULE-5029370261
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 | 106 USD | 97 | 14 working days | Get Quote |
| 5 mg | 106 USD | 97 | 14 working days | Get Quote |
| 10 mg | 106 USD | 97 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5029370261.sdf |
| SMILES | MCULE-5029370261.smiles |
| Standard InChI | MCULE-5029370261.inchi |
| InChIKey | MCULE-5029370261.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867535922 | 97 | As is | in stock |
| P-875690491 | 97 | As is | in stock |
| P-869265556 | 95 | As is | by resynthesis (? - ? days) |
| P-851700072 | N/A | As is | by synthesis |
| P-489160022 | 97 | As is | in stock |
| P-864124828 | 97 | As is | in stock |
| P-591081445 | 97 | As is | by synthesis |
| P-851327759 | 95 | As is | by synthesis |
| P-563494688 | 97 | As is | 1000 mg |
| P-895676807 | 95 | As is | by synthesis |
| P-906785144 | 97 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 291.186 |
| logP | 3.5872 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 19.03 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 80.0147 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| 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 |
