MCULE-1722444114
- 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 | 13 USD | 96 | 11 working days | Get Quote |
5 mg | 13 USD | 96 | 11 working days | Get Quote |
10 mg | 13 USD | 96 | 11 working days | Get Quote |
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1
MCULE-3959517709
- Component type: Main
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2
MCULE-5396813937
- Component type: Counter Ion
Name | File |
---|---|
SDF | MCULE-1722444114.sdf |
SMILES | MCULE-1722444114.smiles |
Standard InChI | MCULE-1722444114.inchi |
InChIKey | MCULE-1722444114.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-616195828 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-868597227 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
P-590931759 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
P-619598886 | BLD pharm | Non-stock building blocks | 98 | Main component as a main component | by synthesis |
P-868618649 | Combi-Blocks | Building Block in stock | 96 | Main component as a main component | in stock |
P-887322188 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
P-861471822 | Combi-Blocks | Building Block on demand | 95 | Main component as a main component | by synthesis |
P-888172509 | Molnova | On demand | 98 | Main component as a main component | by synthesis |
P-617403635 | Selleckchem | Product Catalog | N/A | Main component as a main component | in stock |
Property | Value |
---|---|
Components | 3 |
Mass | 416.240 |
logP | -1.3904 |
H-bond acceptors | 12 |
H-bond donors | 3 |
Rotatable bonds | 9 |
PSA | 242.22 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 52.6564 |
Atoms | 32 |
Rings | 0 |
Heavy atoms | 22 |
Hydrogen atoms | 10 |
Heteroatoms | 16 |
N/O atoms | 12 |
Inorganic atoms | 2 |
Halogen atoms | 0 |
Chiral centers | 3 |
R/S chiral centers | 3 |
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 |