MCULE-9484714523
- 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 | 164 USD | 90 | 8 working days | Get Quote |
5 mg | 340 USD | 94 | 23 working days | Get Quote |
10 mg | 457 USD | 94 | 23 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-9484714523.sdf |
SMILES | MCULE-9484714523.smiles |
Standard InChI | MCULE-9484714523.inchi |
InChIKey | MCULE-9484714523.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596421949 | Asinex | General screening catalog | 90 | As is | unavailable |
P-492218719 | Innovapharm | Building Blocks | 95 | As is | in stock |
P-502486105 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-503492044 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-502353575 | TimTec | Building Block Collection | 90 | As is | in stock |
P-888355141 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-33207419 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 3 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 428.527 |
logP | 2.3664 |
H-bond acceptors | 8 |
H-bond donors | 0 |
Rotatable bonds | 6 |
PSA | 125.66 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 104.779 |
Atoms | 52 |
Rings | 3 |
Heavy atoms | 28 |
Hydrogen atoms | 24 |
Heteroatoms | 10 |
N/O atoms | 8 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 2 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 2 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |