MCULE-8050013846
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
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Guaranteed purity (%) | Delivery time
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1 mg | 35 USD | 90 | 19 working days | Get Quote |
5 mg | 52 USD | 90 | 19 working days | Get Quote |
10 mg | 66 USD | 90 | 19 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-8050013846.sdf |
SMILES | MCULE-8050013846.smiles |
Standard InChI | MCULE-8050013846.inchi |
InChIKey | MCULE-8050013846.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-6826950 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | in stock |
P-656540377 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
P-19395308 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-25106895 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 41 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 312.144 |
logP | 3.7895 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 5 |
PSA | 58.56 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 78.8107 |
Atoms | 31 |
Rings | 2 |
Heavy atoms | 20 |
Hydrogen atoms | 11 |
Heteroatoms | 6 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
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 |