MCULE-1703801542
- 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 | 9 USD | 95 | 20 working days | Get Quote |
5 mg | 9 USD | 95 | 20 working days | Get Quote |
10 mg | 9 USD | 95 | 20 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-2533300368
- Component type: Main
Name | File |
---|---|
SDF | MCULE-1703801542.sdf |
SMILES | MCULE-1703801542.smiles |
Standard InChI | MCULE-1703801542.inchi |
InChIKey | MCULE-1703801542.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867544658 | 95 | As is | in stock |
P-875702480 | N/A | As is | in stock |
P-590379576 | 95 | As is | in stock |
P-903026568 | 96 | As is | 50 g |
P-893557809 | 90 | As is | 77.13 g |
P-606853763 | N/A | As is | in stock |
P-489182565 | 97 | As is | in stock |
P-596939464 | 95 | As is | 20 g |
P-895921077 | 95 | As is | by resynthesis (? - ? days) |
P-864136570 | 95 | As is | in stock |
P-580698912 | 95 | As is | 30.25 g |
P-868578463 | 95 | As is | in stock |
P-580420721 | 95 | As is | by resynthesis (? - ? days) |
P-862030532 | 95 | As is | 33.88 g |
P-901639356 | 95 | As is | 475 mg |
P-524195871 | 95 | As is | 5 g |
P-580478643 | N/A | As is | by synthesis |
P-854747334 | 95 | As is | in stock |
P-871004132 | 90 | As is | 5.499 g |
P-500373760 | 98 | As is | by synthesis |
P-889867033 | 95 | As is | by synthesis |
P-896082465 | N/A | As is | 6 mg |
P-596764935 | 95 | As is | 62.25 g |
P-23147409 | 90 | As is | in stock |
P-611430471 | 90 | As is | in stock |
P-893988559 | 95 | As is | in stock |
P-867637351 | 95 | As a main component | in stock |
P-875803192 | N/A | As a main component | in stock |
P-904515553 | 95 | As a main component | in stock |
P-899921557 | N/A | As a main component | by synthesis |
P-494411181 | 95 | As a main component | by resynthesis (? - ? days) |
P-901871527 | 95 | As a main component | by synthesis |
P-494302425 | 95 | As a main component | in stock |
P-868621335 | 95 | As a main component | in stock |
P-895370344 | 95 | As a main component | by synthesis |
P-611589804 | 90 | As a main component | in stock |
P-893881267 | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 157.211 |
logP | 2.8516 |
H-bond acceptors | 1 |
H-bond donors | 0 |
Rotatable bonds | 0 |
PSA | 12.89 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 51.675 |
Atoms | 23 |
Rings | 2 |
Heavy atoms | 12 |
Hydrogen atoms | 11 |
Heteroatoms | 1 |
N/O atoms | 1 |
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 |