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MCULE-1018595313
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 | 401 USD | 70 | 17 working days | Get Quote |
| 5 mg | 744 USD | 95 | 27 working days | Get Quote |
| 10 mg | 1174 USD | 95 | 35 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1018595313.sdf |
| SMILES | MCULE-1018595313.smiles |
| Standard InChI | MCULE-1018595313.inchi |
| InChIKey | MCULE-1018595313.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892785824 | 95 | As is | by resynthesis (? - ? days) |
| P-25951883 | 70 | As is | 3 mg |
| P-901548038 | 95 | As is | by synthesis |
| P-878208233 | 95 | As is | 5 mg |
| P-878208234 | 95 | As is | 5 mg |
| P-878210095 | 95 | As is | 5 mg |
| P-889864668 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 570.541 |
| logP | 5.0916 |
| H-bond acceptors | 10 |
| H-bond donors | 4 |
| Rotatable bonds | 5 |
| PSA | 151.98 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 149.965 |
| Atoms | 68 |
| Rings | 6 |
| Heavy atoms | 42 |
| Hydrogen atoms | 26 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 4 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
