MCULE-9166584990-0
- 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 | 7 USD | 98 | 14 working days | Get Quote |
5 mg | 7 USD | 98 | 14 working days | Get Quote |
10 mg | 7 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.
-
MCULE-1393832784-0
- Component type: Main
-
MCULE-4723959940-0
- Component type: Main
Name | File |
---|---|
SDF | MCULE-9166584990-0.sdf |
SMILES | MCULE-9166584990-0.smiles |
Standard InChI | MCULE-9166584990-0.inchi |
InChIKey | MCULE-9166584990-0.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867592811 | 98 | As a main component | in stock |
P-867421830 | N/A | As a main component | by synthesis |
P-875751094 | N/A | As a main component | in stock |
P-869189910 | 95 | As a main component | in stock |
P-505348210 | 99 | As a main component | in stock |
P-505348535 | 98 | As a main component | in stock |
P-505404086 | 99 | As a main component | in stock |
P-903082756 | 98 | As a main component | 600 g |
P-893574001 | 90 | As a main component | 74.991 kg |
P-893545399 | 90 | As a main component | 1144.55 kg |
P-489110294 | 97 | As a main component | in stock |
P-489180859 | 97 | As a main component | in stock |
P-596956244 | 98 | As a main component | 1000 g |
P-872723563 | 98 | As a main component | in stock |
P-864130914 | 95 | As a main component | in stock |
P-864184316 | 95 | As a main component | in stock |
P-481176394 | 97 | As a main component | 1.031 kg |
P-893230902 | 95 | As a main component | in stock |
P-893237666 | 95 | As a main component | in stock |
P-505575993 | 98 | As a main component | in stock |
P-851270655 | 95 | As a main component | by synthesis |
P-851250472 | 95 | As a main component | by synthesis |
P-868577244 | 97 | As a main component | in stock |
P-868577952 | 98 | As a main component | in stock |
P-905330977 | 98 | As a main component | 18.975 kg |
P-905339695 | 95 | As a main component | 100 g |
P-862001827 | 95 | As a main component | 509 g |
P-861942234 | 98 | As a main component | 185.222 kg |
P-500417110 | 99 | As a main component | in stock |
P-870653802 | 99 | As a main component | in stock |
P-505514186 | 95 | As a main component | in stock |
P-524162106 | 98 | As a main component | 100 g |
P-524161999 | 99 | As a main component | 100 g |
P-856019901 | 90 | As a main component | unavailable |
P-613332917 | 95 | As a main component | by synthesis |
P-580516402 | 98 | As a main component | 1.246 kg |
P-611665225 | N/A | As a main component | by synthesis |
P-852435258 | N/A | As a main component | in stock |
P-852458793 | N/A | As a main component | in stock |
P-854738059 | 95 | As a main component | in stock |
P-878647157 | 98 | As a main component | in stock |
P-674876490 | 90 | As a main component | 1000 mg |
P-674953897 | 95 | As a main component | 1000 mg |
P-579714351 | N/A | As a main component | in stock |
P-500371206 | 98 | As a main component | by synthesis |
P-885535136 | 95 | As a main component | by synthesis |
P-596791359 | 98 | As a main component | 1.67677 kg |
P-502364407 | 90 | As a main component | in stock |
P-855313300 | 90 | As a main component | in stock |
P-615391819 | 95 | As a main component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 235.266 |
logP | -0.5554 |
H-bond acceptors | 7 |
H-bond donors | 0 |
Rotatable bonds | 3 |
PSA | 59.08 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 62.4654 |
Atoms | 32 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 15 |
Heteroatoms | 7 |
N/O atoms | 7 |
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 |