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MCULE-5959440652
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 | 36 USD | 90 | 26 working days | Get Quote |
| 5 mg | 36 USD | 90 | 26 working days | Get Quote |
| 10 mg | 41 USD | 90 | 26 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-5959440652.sdf |
| SMILES | MCULE-5959440652.smiles |
| Standard InChI | MCULE-5959440652.inchi |
| InChIKey | MCULE-5959440652.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867447245 | N/A | As is | by synthesis |
| P-853439767 | 95 | As is | in stock |
| P-1263691095 | N/A | As is | by synthesis |
| P-851901028 | N/A | As is | by synthesis |
| P-4598553 | 90 | As is | 100 mg |
| P-19877520 | 90 | As is | in stock |
| P-861301406 | 90 | As is | by synthesis |
| P-580303322 | 95 | As is | by resynthesis (? - ? days) |
| P-502446138 | 95 | As is | by synthesis |
| P-502756693 | 90 | As is | in stock |
| P-18791591 | 90 | As is | 8.485 g |
| P-454401909 | 90 | As is | 8.485 g |
| P-856013363 | 90 | As is | 10 g |
| P-35204302 | 97 | As is | 10.346 kg |
| P-26457766 | 90 | As is | 55 mg |
| P-19513197 | 90 | As is | in stock |
| P-22774250 | 90 | As is | in stock |
| P-502393971 | 90 | As is | in stock |
| P-888432094 | 94 | As is | by resynthesis (? - ? days) |
| P-855335343 | 90 | As is | in stock |
| P-2977331 | 90 | As is | 13 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 172.183 |
| logP | 1.77918 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 66.88 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 48.8034 |
| Atoms | 21 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
