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MCULE-1442493959-0
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 | 50 USD | 90 | 21 working days | Get Quote |
| 5 mg | 75 USD | 90 | 21 working days | Get Quote |
| 10 mg | 87 USD | 90 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1442493959-0.sdf |
| SMILES | MCULE-1442493959-0.smiles |
| Standard InChI | MCULE-1442493959-0.inchi |
| InChIKey | MCULE-1442493959-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886420892 | 90 | As is | by synthesis |
| P-1265550641 | 90 | As is | by synthesis |
| P-1263679536 | N/A | As is | by synthesis |
| P-1263333723 | 90 | As is | by synthesis |
| P-8517096 | 90 | As is | 9 mg |
| P-579496528 | 90 | As is | 30 mg |
| P-454357443 | 90 | As is | 34 mg |
| P-14737118 | 90 | As is | 247 mg |
| P-895858647 | 95 | As is | by synthesis |
| P-859967009 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 261.251 |
| logP | 2.1026 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 59.23 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 68.551 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
