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MCULE-3758949481
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 | 71 USD | 97 | 15 working days | Get Quote |
| 5 mg | 71 USD | 97 | 15 working days | Get Quote |
| 10 mg | 71 USD | 97 | 15 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-2164746602
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3758949481.sdf |
| SMILES | MCULE-3758949481.smiles |
| Standard InChI | MCULE-3758949481.inchi |
| InChIKey | MCULE-3758949481.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903299483 | 97 | As is | 200 mg |
| P-893588720 | 90 | As is | 10.982 g |
| P-674400667 | 97 | As is | 2.242 g |
| P-887229721 | 95 | As is | by synthesis |
| P-872607689 | 95 | As is | in stock |
| P-854718074 | 95 | As is | in stock |
| P-871070558 | 95 | As is | in stock |
| P-878646027 | 98 | As is | in stock |
| P-906814114 | 97 | As is | by synthesis |
| P-890233780 | 98 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 601.118 |
| logP | 7.9662 |
| H-bond acceptors | 9 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 126.51 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 169.5111 |
| Atoms | 71 |
| Rings | 6 |
| Heavy atoms | 42 |
| Hydrogen atoms | 29 |
| Heteroatoms | 11 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
