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UNKNOWN STEREO
MCULE-1187631130
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 | 26 USD | 99 | 20 working days | Get Quote |
| 5 mg | 32 USD | 95 | 7 working days | Get Quote |
| 10 mg | 60 USD | 95 | 7 working days | Get Quote |
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MCULE-8300412745
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1187631130.sdf |
| SMILES | MCULE-1187631130.smiles |
| Standard InChI | MCULE-1187631130.inchi |
| InChIKey | MCULE-1187631130.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875756772 | 99 | As is | in stock |
| P-597005995 | 98 | As is | 500 mg |
| P-864201755 | 95 | As is | in stock |
| P-893260733 | 95 | As is | by synthesis |
| P-611459610 | 90 | As is | in stock |
| P-875834679 | N/A | As a main component | in stock |
| P-1275187640 | 99 | As a main component | in stock |
| P-1275153509 | 97 | As a main component | in stock |
| P-596973884 | 99 | As a main component | 50 mg |
| P-864118066 | 95 | As a main component | in stock |
| P-868543732 | 98 | As a main component | in stock |
| P-893219409 | 95 | As a main component | in stock |
| P-893236718 | 95 | As a main component | in stock |
| P-500397844 | 98 | As a main component | by synthesis |
| P-892271039 | 95 | As a main component | unavailable |
| P-892298074 | 95 | As a main component | unavailable |
| P-892348880 | 95 | As a main component | unavailable |
| P-869162615 | 95 | As a main component | 162 mg |
| P-888657972 | 95 | As a main component | 162 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 313.390 |
| logP | 3.5226 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 39.72 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 93.6357 |
| Atoms | 46 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 23 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
