MCULE-5082832123-1
- 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 | 310 USD | 90 | 25 working days | Get Quote |
5 mg | 340 USD | 94 | 23 working days | Get Quote |
10 mg | 412 USD | 90 | 25 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-5082832123-1.sdf |
SMILES | MCULE-5082832123-1.smiles |
Standard InChI | MCULE-5082832123-1.inchi |
InChIKey | MCULE-5082832123-1.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596421029 | Asinex | General screening catalog | 90 | As is | 89 mg |
P-873081149 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
Property | Value |
---|---|
Components | 1 |
Mass | 303.381 |
logP | 2.4989 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 100.15 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 85.3104 |
Atoms | 38 |
Rings | 2 |
Heavy atoms | 21 |
Hydrogen atoms | 17 |
Heteroatoms | 6 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |