MCULE-2535678568
- 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 | 45 USD | 90 | 22 working days | Get Quote |
10 mg | 60 USD | 90 | 22 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-2535678568.sdf |
SMILES | MCULE-2535678568.smiles |
Standard InChI | MCULE-2535678568.inchi |
InChIKey | MCULE-2535678568.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596320300 | Asinex | General screening catalog | 90 | As is | 208 mg |
P-4235804 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 100 mg |
P-4854547 | ChemDiv | Discovery Chemistry Library | 90 | As is | 1 mg |
P-63080 | Chemical Block | Screening Library | 90 | As is | 11 mg |
P-34756268 | Crea-Chim | HTS compounds | 90 | As is | by resynthesis (? - ? days) |
P-503864826 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
P-19198812 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-33446356 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
P-888362916 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-956206 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 95 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 304.181 |
logP | 4.331 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 4 |
PSA | 29.1 |
RO5 violations | 0 |
RO3 violations | 3 |
Refractivity | 76.4322 |
Atoms | 32 |
Rings | 2 |
Heavy atoms | 18 |
Hydrogen atoms | 14 |
Heteroatoms | 3 |
N/O atoms | 2 |
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 |