MCULE-7730470706
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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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 | 173 USD | 90 | 25 working days | Get Quote |
5 mg | 242 USD | 90 | 25 working days | Get Quote |
10 mg | 277 USD | 90 | 25 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-7730470706.sdf |
SMILES | MCULE-7730470706.smiles |
Standard InChI | MCULE-7730470706.inchi |
InChIKey | MCULE-7730470706.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596215259 | Asinex | General screening catalog | 90 | As is | 77 mg |
P-647778433 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
P-23150559 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
Property | Value |
---|---|
Components | 1 |
Mass | 355.405 |
logP | 3.9622 |
H-bond acceptors | 5 |
H-bond donors | 2 |
Rotatable bonds | 6 |
PSA | 61.44 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 102.5099 |
Atoms | 48 |
Rings | 3 |
Heavy atoms | 26 |
Hydrogen atoms | 22 |
Heteroatoms | 6 |
N/O atoms | 5 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |