MCULE-9872051560
- 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 | 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-9872051560.sdf |
SMILES | MCULE-9872051560.smiles |
Standard InChI | MCULE-9872051560.inchi |
InChIKey | MCULE-9872051560.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-619841942 | ChemDiv | Discovery Chemistry Library | 90 | As is | 22 mg |
P-34475424 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-23860578 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-22668406 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-1149312 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 48 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 310.349 |
logP | 1.8951 |
H-bond acceptors | 8 |
H-bond donors | 0 |
Rotatable bonds | 5 |
PSA | 93.18 |
RO5 violations | 0 |
RO3 violations | 4 |
Refractivity | 86.681 |
Atoms | 44 |
Rings | 2 |
Heavy atoms | 22 |
Hydrogen atoms | 22 |
Heteroatoms | 8 |
N/O atoms | 8 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 2 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 2 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |