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MCULE-4696974877
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 | 26 USD | 98 | 22 working days | Get Quote |
| 5 mg | 26 USD | 98 | 22 working days | Get Quote |
| 10 mg | 45 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4696974877.sdf |
| SMILES | MCULE-4696974877.smiles |
| Standard InChI | MCULE-4696974877.inchi |
| InChIKey | MCULE-4696974877.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266340933 | 98 | As is | in stock |
| P-1265981436 | 98 | As is | in stock |
| P-903460405 | 98 | As is | 200 mg |
| P-1270345452 | 98 | As is | in stock |
| P-1264207472 | N/A | As is | by synthesis |
| P-1272050504 | 98 | As is | 200 mg |
| P-1273408813 | 95 | As is | by resynthesis (? - ? days) |
| P-889789660 | 95 | As is | in stock |
| P-1264197700 | 98 | As is | by synthesis |
| P-899784736 | 97 | As is | 5 mg |
| P-1263697998 | 95 | As is | in stock |
| P-906859332 | 98 | As is | by synthesis |
| P-1279561164 | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 440.299 |
| logP | 5.4986 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 109.68 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 107.4024 |
| Atoms | 43 |
| Rings | 3 |
| Heavy atoms | 28 |
| Hydrogen atoms | 15 |
| Heteroatoms | 10 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
