MCULE-4802961874
- 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 | 68 USD | 90 | 10 working days | Get Quote |
5 mg | 85 USD | 90 | 10 working days | Get Quote |
10 mg | 116 USD | 90 | 10 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-4802961874.sdf |
SMILES | MCULE-4802961874.smiles |
Standard InChI | MCULE-4802961874.inchi |
InChIKey | MCULE-4802961874.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852133823 | A2B Chem | Predominantly Building Block on demand | 90 | As is | by synthesis |
P-851691376 | AmBeed | On request | N/A | As is | by synthesis |
P-502607859 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-502669994 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-502830869 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-454409958 | Key Organics | Building Blocks | 90 | As is | 2.325 g |
P-18737004 | Key Organics | Screening Compounds and Fragments | 90 | As is | 2.325 g |
P-33816752 | TimTec | ActiMol 6 Week | 90 | As is | in stock |
P-855331408 | Toronto Research | In stock | 90 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 377.890 |
logP | 6.5258 |
H-bond acceptors | 3 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 65.52 |
RO5 violations | 1 |
RO3 violations | 4 |
Refractivity | 112.3507 |
Atoms | 42 |
Rings | 4 |
Heavy atoms | 26 |
Hydrogen atoms | 16 |
Heteroatoms | 5 |
N/O atoms | 3 |
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 | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |