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UNKNOWN STEREO
MCULE-1654712273-0
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 | 29 USD | 98 | 27 working days | Get Quote |
| 5 mg | 38 USD | 98 | 22 working days | Get Quote |
| 10 mg | 43 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1654712273-0.sdf |
| SMILES | MCULE-1654712273-0.smiles |
| Standard InChI | MCULE-1654712273-0.inchi |
| InChIKey | MCULE-1654712273-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867568108 | 98 | As is | in stock |
| P-875728108 | 98 | As is | in stock |
| P-613854134 | 98 | As is | by resynthesis (? - ? days) |
| P-1270362667 | 98 | As is | in stock |
| P-606918614 | N/A | As is | in stock |
| P-596948212 | 98 | As is | 5 g |
| P-864150179 | 95 | As is | in stock |
| P-868544984 | 98 | As is | in stock |
| P-893232290 | 95 | As is | in stock |
| P-860799578 | 98 | As is | in stock |
| P-505546781 | 95 | As is | in stock |
| P-500412471 | 98 | As is | by synthesis |
| P-892290933 | 95 | As is | unavailable |
| P-869126381 | 95 | As is | 48 mg |
| P-888639777 | 95 | As is | 47 mg |
| P-855005033 | 90 | As is | in stock |
| P-575300645 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 361.028 |
| logP | 2.4678 |
| H-bond acceptors | 6 |
| H-bond donors | 4 |
| Rotatable bonds | 9 |
| PSA | 98.66 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 90.4365 |
| Atoms | 42 |
| Rings | 1 |
| Heavy atoms | 23 |
| Hydrogen atoms | 19 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
