MCULE-5818136670
- 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.
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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.
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1 mg | 89 USD | 90 | 17 working days | Get Quote |
5 mg | 340 USD | 94 | 23 working days | Get Quote |
10 mg | 399 USD | 90 | 25 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-5818136670.sdf |
SMILES | MCULE-5818136670.smiles |
Standard InChI | MCULE-5818136670.inchi |
InChIKey | MCULE-5818136670.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596315208 | Asinex | General screening catalog | 90 | As is | 100 mg |
P-3447300 | ChemDiv | Discovery Chemistry Library | 90 | As is | 2 mg |
P-502762711 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-643086455 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
P-23334339 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-873073839 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
Property | Value |
---|---|
Components | 1 |
Mass | 400.250 |
logP | 5.3149 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 7 |
PSA | 55.4 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 106.6622 |
Atoms | 42 |
Rings | 3 |
Heavy atoms | 27 |
Hydrogen atoms | 15 |
Heteroatoms | 6 |
N/O atoms | 4 |
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 |