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MCULE-3127799990
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 | 180 USD | 95 | 7 working days | Get Quote |
| 5 mg | 327 USD | 95 | 20 working days | Get Quote |
| 10 mg | 327 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3127799990.sdf |
| SMILES | MCULE-3127799990.smiles |
| Standard InChI | MCULE-3127799990.inchi |
| InChIKey | MCULE-3127799990.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-901189585 | 95 | As is | by synthesis |
| P-903107748 | 95 | As is | 500 mg |
| P-590941242 | 95 | As is | by synthesis |
| P-1267047128 | 95 | As is | in stock |
| P-878644210 | 98 | As is | in stock |
| P-867295385 | N/A | As an isomer | by synthesis |
| P-869295180 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-1264058315 | 98 | As an isomer | in stock |
| P-851771342 | N/A | As an isomer | by synthesis |
| P-489231415 | 97 | As an isomer | in stock |
| P-900245436 | 95 | As an isomer | 500 mg |
| P-1273288803 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-901462787 | 95 | As an isomer | by synthesis |
| P-1263659817 | 95 | As an isomer | in stock |
| P-580443983 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-869179685 | 95 | As an isomer | in stock |
| P-1274336076 | 95 | As an isomer | unavailable |
| P-892279555 | 95 | As an isomer | 186 mg |
| P-892354438 | 95 | As an isomer | 6 mg |
| P-906793899 | 95 | As an isomer | by synthesis |
| P-855344282 | 90 | As an isomer | in stock |
| P-1271627593 | 99 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 288.251 |
| logP | 2.1107 |
| H-bond acceptors | 6 |
| H-bond donors | 5 |
| Rotatable bonds | 3 |
| PSA | 118.22 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 76.3635 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
