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UNKNOWN STEREO
MCULE-1807066636-0
Structure
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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 | 7 USD | 95 | 20 working days | Get Quote |
| 5 mg | 7 USD | 95 | 20 working days | Get Quote |
| 10 mg | 7 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1807066636-0.sdf |
| SMILES | MCULE-1807066636-0.smiles |
| Standard InChI | MCULE-1807066636-0.inchi |
| InChIKey | MCULE-1807066636-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867608903 | 98 | As is | in stock |
| P-875767841 | 98 | As is | in stock |
| P-588247371 | 95 | As is | by resynthesis (? - ? days) |
| P-1270382093 | 96 | As is | in stock |
| P-606908215 | N/A | As is | in stock |
| P-596961842 | 95 | As is | 75 g |
| P-864153748 | 91 | As is | in stock |
| P-893241314 | 95 | As is | in stock |
| P-505513122 | 95 | As is | in stock |
| P-869176141 | 95 | As is | in stock |
| P-892292491 | 95 | As is | unavailable |
| P-892235548 | 95 | As is | 190 mg |
| P-892326453 | 95 | As is | 190 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 464.375 |
| logP | 0.1943 |
| H-bond acceptors | 12 |
| H-bond donors | 8 |
| Rotatable bonds | 3 |
| PSA | 210.51 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 111.0184 |
| Atoms | 53 |
| Rings | 4 |
| Heavy atoms | 33 |
| Hydrogen atoms | 20 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
