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MCULE-7997690681
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 | 39 USD | 90 | 22 working days | Get Quote |
| 5 mg | 57 USD | 90 | 22 working days | Get Quote |
| 10 mg | 72 USD | 90 | 22 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-7997690681.sdf |
| SMILES | MCULE-7997690681.smiles |
| Standard InChI | MCULE-7997690681.inchi |
| InChIKey | MCULE-7997690681.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-503391840 | 90 | As is | by synthesis |
| P-502727495 | 90 | As is | in stock |
| P-650923522 | 90 | As is | by synthesis |
| P-12351835 | 90 | As is | 1 mg |
| P-19765204 | 90 | As is | in stock |
| P-454017062 | 90 | As is | 20 mg |
| P-23210433 | 90 | As is | in stock |
| P-907288153 | 94 | As is | by resynthesis (? - ? days) |
| P-596705762 | 90 | As is | 2 mg |
| P-2745393 | 90 | As is | 53 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 386.452 |
| logP | 3.2726 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 149.29 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 106.7043 |
| Atoms | 40 |
| Rings | 3 |
| Heavy atoms | 26 |
| Hydrogen atoms | 14 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 2 |
| Undefined stereo double bonds | 0 |
