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UNKNOWN STEREO
MCULE-1669268139
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 | 45 USD | 99 | 20 working days | Get Quote |
| 5 mg | 127 USD | 99 | 20 working days | Get Quote |
| 10 mg | 213 USD | 99 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-7990691552
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1669268139.sdf |
| SMILES | MCULE-1669268139.smiles |
| Standard InChI | MCULE-1669268139.inchi |
| InChIKey | MCULE-1669268139.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867616715 | 95 | As is | in stock |
| P-875777862 | N/A | As is | in stock |
| P-888934580 | N/A | As is | in stock |
| P-888817199 | 99 | As is | 250 mg |
| P-881654051 | 98 | As is | in stock |
| P-868079568 | 95 | As is | in stock |
| P-869175042 | 95 | As is | by synthesis |
| P-904255745 | 95 | As is | unavailable |
| P-888664819 | 95 | As is | 48 mg |
| P-886962103 | 95 | As is | by synthesis |
| P-904222643 | 95 | As a main component | by synthesis |
| P-904239051 | 95 | As a main component | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 316.369 |
| logP | 2.8941 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 58.28 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 85.5936 |
| Atoms | 44 |
| Rings | 4 |
| Heavy atoms | 23 |
| Hydrogen atoms | 21 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 4 |
| R/S chiral centers | 4 |
| 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 |
