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MCULE-1383380728
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 | 86 USD | 95 | 20 working days | Get Quote |
| 5 mg | 86 USD | 95 | 20 working days | Get Quote |
| 10 mg | 86 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1383380728.sdf |
| SMILES | MCULE-1383380728.smiles |
| Standard InChI | MCULE-1383380728.inchi |
| InChIKey | MCULE-1383380728.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886695007 | 95 | As is | in stock |
| P-1265914560 | 95 | As is | in stock |
| P-902997585 | 95 | As is | by resynthesis (? - ? days) |
| P-1264673769 | 95 | As is | 1.31 g |
| P-1270398167 | 95 | As is | in stock |
| P-892509407 | N/A | As is | in stock |
| P-1271996514 | 95 | As is | 1.31 g |
| P-1273374721 | 95 | As is | by resynthesis (? - ? days) |
| P-905463934 | 95 | As is | in stock |
| P-1263256683 | 95 | As is | by synthesis |
| P-855376789 | 90 | As is | in stock |
| P-502572696 | 95 | As is | by synthesis |
| P-613310587 | 95 | As is | by synthesis |
| P-1279657612 | N/A | As is | in stock |
| P-1279059474 | N/A | As is | by synthesis |
| P-895563847 | 95 | As is | by synthesis |
| P-855267721 | 90 | As is | in stock |
| P-1271671176 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 117.189 |
| logP | 1.1965 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 46.25 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 34.8252 |
| Atoms | 23 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 15 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
