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UNKNOWN STEREO
MCULE-1303528930
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 | 15 USD | 97 | 22 working days | Get Quote |
| 5 mg | 15 USD | 97 | 22 working days | Get Quote |
| 10 mg | 15 USD | 97 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1303528930.sdf |
| SMILES | MCULE-1303528930.smiles |
| Standard InChI | MCULE-1303528930.inchi |
| InChIKey | MCULE-1303528930.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867667991 | 97 | As is | in stock |
| P-1275179511 | 97 | As is | in stock |
| P-1275180592 | 98 | As is | in stock |
| P-1275145599 | 95 | As is | in stock |
| P-606925406 | N/A | As is | in stock |
| P-596973979 | 98 | As is | 10 g |
| P-864141922 | 95 | As is | in stock |
| P-893218577 | 95 | As is | in stock |
| P-500143529 | 95 | As is | in stock |
| P-488555844 | 92 | As is | in stock |
| P-488544212 | 90 | As is | in stock |
| P-454364852 | 92 | As is | in stock |
| P-500371937 | 98 | As is | by synthesis |
| P-611362514 | 90 | As is | in stock |
| P-855363453 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 785.876 |
| logP | 6.2958 |
| H-bond acceptors | 14 |
| H-bond donors | 5 |
| Rotatable bonds | 3 |
| PSA | 198.38 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 219.2298 |
| Atoms | 108 |
| Rings | 6 |
| Heavy atoms | 57 |
| Hydrogen atoms | 51 |
| Heteroatoms | 14 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 9 |
| R/S chiral centers | 9 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 3 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 3 |
| Undefined stereo double bonds | 0 |
