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UNKNOWN STEREO
MCULE-9887025748
Compound
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- InChIKey:
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- 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.
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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.
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|
|---|---|---|---|---|
| 1 mg | 6 USD | N/A | 14 working days | Get Quote |
| 5 mg | 10 USD | N/A | 14 working days | Get Quote |
| 10 mg | 10 USD | N/A | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-9887025748.sdf |
| SMILES | MCULE-9887025748.smiles |
| Standard InChI | MCULE-9887025748.inchi |
| InChIKey | MCULE-9887025748.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-608474705 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606904712 | AmBeed | In stock | N/A | As is | in stock |
| P-488555384 | InterBioScreen | Bioactive compounds | 92 | As is | in stock |
| P-500379590 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-869175324 | TargetMol | Natural Products | 95 | As is | 90.861 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 588.555 |
| logP | 1.3386 |
| H-bond acceptors | 13 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 160.83 |
| RO5 violations | 2 |
| RO3 violations | 4 |
| Refractivity | 139.1076 |
| Atoms | 74 |
| Rings | 7 |
| Heavy atoms | 42 |
| Hydrogen atoms | 32 |
| Heteroatoms | 13 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
