MCULE-9287831856
- 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-9287831856.sdf |
SMILES | MCULE-9287831856.smiles |
Standard InChI | MCULE-9287831856.inchi |
InChIKey | MCULE-9287831856.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-893039888 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-504788577 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-4165857 | ChemDiv | Discovery Chemistry Library | 90 | As is | 13 mg |
P-502602093 | Innovapharm | Screening Compounds | 90 | As is | in stock |
P-12494885 | Otava | In-House Stock Library | 90 | As is | 50 mg |
P-18837088 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-2268761 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 105 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 454.533 |
logP | 4.3908 |
H-bond acceptors | 6 |
H-bond donors | 1 |
Rotatable bonds | 10 |
PSA | 70.08 |
RO5 violations | 0 |
RO3 violations | 5 |
Refractivity | 129.5003 |
Atoms | 64 |
Rings | 3 |
Heavy atoms | 33 |
Hydrogen atoms | 31 |
Heteroatoms | 7 |
N/O atoms | 6 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |