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UNKNOWN STEREO
MCULE-1515081556
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 | 13 USD | 97 | 20 working days | Get Quote |
| 5 mg | 13 USD | 97 | 20 working days | Get Quote |
| 10 mg | 13 USD | 97 | 20 working days | Get Quote |
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MCULE-3961512269
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1515081556.sdf |
| SMILES | MCULE-1515081556.smiles |
| Standard InChI | MCULE-1515081556.inchi |
| InChIKey | MCULE-1515081556.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867571187 | 95 | As is | in stock |
| P-875732672 | 95 | As is | in stock |
| P-1270362074 | 95 | As is | in stock |
| P-606952293 | N/A | As is | in stock |
| P-596949941 | 97 | As is | 300 g |
| P-864086296 | 95 | As is | in stock |
| P-580378057 | N/A | As is | by resynthesis (? - ? days) |
| P-878262598 | 98 | As is | in stock |
| P-892293231 | 95 | As is | unavailable |
| P-869148503 | 95 | As is | 987 mg |
| P-888649768 | 95 | As is | 987 mg |
| P-611408750 | 90 | As is | in stock |
| P-615451546 | 97 | As is | in stock |
| P-886800528 | 95 | As a main component | in stock |
| P-890081664 | 95 | As a main component | by synthesis |
| P-1263681455 | N/A | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 145.199 |
| logP | 1.5348 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 39.9822 |
| Atoms | 25 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 15 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
