MCULE-3870478096
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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Guaranteed purity (%) | Delivery time
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1 mg | 35 USD | 90 | 17 working days | Get Quote |
5 mg | 52 USD | 90 | 17 working days | Get Quote |
10 mg | 67 USD | 90 | 17 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-3870478096.sdf |
SMILES | MCULE-3870478096.smiles |
Standard InChI | MCULE-3870478096.inchi |
InChIKey | MCULE-3870478096.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-893081769 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-502757315 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-502485732 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
P-503491501 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-13381997 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-491323723 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-33893894 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-25675844 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 63 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 233.330 |
logP | 1.7588 |
H-bond acceptors | 4 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 62.83 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 60.13 |
Atoms | 34 |
Rings | 1 |
Heavy atoms | 15 |
Hydrogen atoms | 19 |
Heteroatoms | 5 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 1 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 1 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |