MCULE-5889962150
- 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 | 6 USD | 98 | 14 working days | Get Quote |
5 mg | 6 USD | 98 | 14 working days | Get Quote |
10 mg | 6 USD | 98 | 14 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.
Name | File |
---|---|
SDF | MCULE-5889962150.sdf |
SMILES | MCULE-5889962150.smiles |
Standard InChI | MCULE-5889962150.inchi |
InChIKey | MCULE-5889962150.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867579130 | 97 | As is | in stock |
P-875738661 | N/A | As is | in stock |
P-535624989 | 95 | As is | in stock |
P-505392912 | 98 | As is | in stock |
P-903068925 | 98 | As is | 2.5 kg |
P-580199870 | 95 | As is | 40 g |
P-893335612 | 95 | As is | by synthesis |
P-606885662 | N/A | As is | in stock |
P-489158240 | 97 | As is | in stock |
P-596952125 | 98 | As is | 1.5 kg |
P-494344922 | 95 | As is | 56.1 g |
P-864103019 | 95 | As is | in stock |
P-580723127 | 97 | As is | 1.17 kg |
P-893225899 | 95 | As is | in stock |
P-619930365 | 90 | As is | by synthesis |
P-189102 | 90 | As is | 1 mg |
P-851274040 | 95 | As is | by synthesis |
P-868577514 | 98 | As is | in stock |
P-34737901 | 90 | As is | in stock |
P-580432534 | 95 | As is | by resynthesis (? - ? days) |
P-905335587 | 97 | As is | 73 g |
P-861981102 | 97 | As is | 3.33257 kg |
P-494300832 | 98 | As is | in stock |
P-888314327 | N/A | As is | in stock |
P-870657781 | N/A | As is | in stock |
P-502856407 | 90 | As is | in stock |
P-675513815 | 95 | As is | in stock |
P-488548642 | 90 | As is | in stock |
P-855997866 | 97 | As is | 100 mg |
P-454412933 | 97 | As is | 100 g |
P-579612061 | 95 | As is | 1000 g |
P-31270295 | 90 | As is | 10 g |
P-580512683 | 97 | As is | 500 g |
P-852443618 | N/A | As is | in stock |
P-854726482 | 95 | As is | in stock |
P-492286118 | 95 | As is | 1000 mg |
P-12993202 | 90 | As is | 352 mg |
P-454367616 | 92 | As is | in stock |
P-500389970 | 96 | As is | by synthesis |
P-885548624 | 95 | As is | by synthesis |
P-23847505 | 90 | As is | in stock |
P-596757878 | 97 | As is | 1.28 kg |
P-33505662 | 90 | As is | in stock |
P-502330571 | 90 | As is | in stock |
P-906768263 | 98 | As is | by synthesis |
P-611369820 | 90 | As is | in stock |
P-3244558 | 90 | As is | 1.869 g |
P-893995326 | 95 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 156.564 |
logP | 1.8581 |
H-bond acceptors | 2 |
H-bond donors | 1 |
Rotatable bonds | 1 |
PSA | 37.3 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 38.8625 |
Atoms | 15 |
Rings | 1 |
Heavy atoms | 10 |
Hydrogen atoms | 5 |
Heteroatoms | 3 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 1 |
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 |