MCULE-2517288272-0
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
![]() Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
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.
|
|
---|---|---|---|---|
1 mg | 22 USD | 95 | 15 working days | Get Quote |
5 mg | 22 USD | 95 | 15 working days | Get Quote |
10 mg | 22 USD | 95 | 15 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
-
MCULE-4937391812-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-2517288272-0.sdf |
SMILES | MCULE-2517288272-0.smiles |
Standard InChI | MCULE-2517288272-0.inchi |
InChIKey | MCULE-2517288272-0.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867593039 | 95 | As is | in stock |
P-875751983 | N/A | As is | in stock |
P-590393581 | 95 | As is | in stock |
P-903083773 | 97 | As is | 5 g |
P-610977646 | 90 | As is | 21.1 g |
P-606910410 | N/A | As is | in stock |
P-489188993 | 97 | As is | in stock |
P-596956370 | 97 | As is | 5 g |
P-596498007 | 90 | As is | 1000 mg |
P-596458880 | 90 | As is | 1000 mg |
P-864103954 | 95 | As is | in stock |
P-580701996 | 95 | As is | 2.65 g |
P-851264851 | 95 | As is | by synthesis |
P-868581543 | 98 | As is | in stock |
P-580415459 | 95 | As is | by resynthesis (? - ? days) |
P-454319354 | 90 | As is | unavailable |
P-608101768 | 95 | As is | 5 g |
P-580476491 | N/A | As is | by synthesis |
P-852402527 | N/A | As is | in stock |
P-854792328 | 95 | As is | by synthesis |
P-596782882 | 95 | As is | 6.25 g |
P-502334953 | 90 | As is | in stock |
P-33602539 | 94 | As is | by resynthesis (? - ? days) |
P-906829832 | 95 | As is | by synthesis |
P-855302759 | 90 | As is | in stock |
P-575301656 | 95 | As is | in stock |
P-886691969 | 95 | As a main component | in stock |
P-889993302 | N/A | As a main component | by synthesis |
P-869201073 | 95 | As a main component | in stock |
P-903259381 | 95 | As a main component | 5 g |
P-851715941 | N/A | As a main component | by synthesis |
P-611068576 | 95 | As a main component | by synthesis |
P-901481912 | 95 | As a main component | by synthesis |
P-861387836 | 95 | As a main component | by synthesis |
P-854792329 | 95 | As a main component | by synthesis |
P-611400359 | 90 | As a main component | in stock |
P-893743189 | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 221.252 |
logP | 1.1549 |
H-bond acceptors | 4 |
H-bond donors | 1 |
Rotatable bonds | 3 |
PSA | 49.77 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 63.3773 |
Atoms | 31 |
Rings | 2 |
Heavy atoms | 16 |
Hydrogen atoms | 15 |
Heteroatoms | 4 |
N/O atoms | 4 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
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 |