Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1743491276-0
Structure
Show compound
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 18 USD | 95 | 26 working days | Get Quote |
| 5 mg | 18 USD | 95 | 26 working days | Get Quote |
| 10 mg | 18 USD | 95 | 26 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-1790659983-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1743491276-0.sdf |
| SMILES | MCULE-1743491276-0.smiles |
| Standard InChI | MCULE-1743491276-0.inchi |
| InChIKey | MCULE-1743491276-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875834598 | 98 | As is | in stock |
| P-1275158024 | 95 | As is | in stock |
| P-893605723 | 90 | As is | 6.989 g |
| P-1270322369 | 98 | As is | in stock |
| P-892509097 | N/A | As is | in stock |
| P-865927424 | 98 | As is | 5 g |
| P-896031376 | 95 | As is | in stock |
| P-860054848 | 9 | As is | by synthesis |
| P-892411803 | 98 | As is | 250 mg |
| P-893232562 | 95 | As is | in stock |
| P-851284981 | 95 | As is | by synthesis |
| P-889734380 | 95 | As is | in stock |
| P-1273140609 | 98 | As is | 10 g |
| P-524443015 | 97 | As is | 517 mg |
| P-31194712 | 90 | As is | 500 mg |
| P-1275597347 | 95 | As is | in stock |
| P-1264392709 | 95 | As is | in stock |
| P-1264431163 | 95 | As is | in stock |
| P-500398038 | 99 | As is | by synthesis |
| P-617402956 | 98 | As is | in stock |
| P-892288727 | 95 | As is | unavailable |
| P-869118042 | 95 | As is | 40 mg |
| P-888633160 | 95 | As is | 40 mg |
| P-502335859 | 90 | As is | in stock |
| P-33162987 | 90 | As is | 984 mg |
| P-855050374 | 90 | As is | in stock |
| P-1271687594 | 98 | As is | in stock |
| P-1275158023 | 95 | As a main component | in stock |
| P-1275163481 | 98 | As a main component | in stock |
| P-1275179386 | 98 | As a main component | in stock |
| P-580243666 | 95 | As a main component | by synthesis |
| P-489119995 | 97 | As a main component | in stock |
| P-1273456846 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1273473408 | 95 | As a main component | by resynthesis (? - ? days) |
| P-864141611 | 95 | As a main component | in stock |
| P-851278419 | 95 | As a main component | by synthesis |
| P-580450321 | 99 | As a main component | in stock |
| P-579476541 | 95 | As a main component | in stock |
| P-862061241 | 95 | As a main component | 100 g |
| P-608220550 | 98 | As a main component | in stock |
| P-675216254 | 95 | As a main component | in stock |
| P-890851137 | 90 | As a main component | in stock |
| P-524441851 | 97 | As a main component | 85 mg |
| P-852444415 | 95 | As a main component | by synthesis |
| P-854715596 | 95 | As a main component | in stock |
| P-899991448 | 95 | As a main component | by synthesis |
| P-474024570 | 95 | As a main component | in stock |
| P-608278174 | 98 | As a main component | in stock |
| P-608278175 | 98 | As a main component | in stock |
| P-881187884 | 90 | As a main component | 600 mg |
| P-889867464 | 95 | As a main component | by synthesis |
| P-579711040 | 98 | As a main component | in stock |
| P-892289392 | 95 | As a main component | unavailable |
| P-869120245 | 95 | As a main component | 202 mg |
| P-888635063 | 95 | As a main component | 202 mg |
| P-1272923385 | 94 | As a main component | by resynthesis (? - ? days) |
| P-611452932 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 351.347 |
| logP | 2.1897 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 74.57 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 97.318 |
| Atoms | 44 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 19 |
| Heteroatoms | 8 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
