Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2659321975
Compound
Show structure
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 | 12 USD | 95 | 20 working days | Get Quote |
| 5 mg | 12 USD | 95 | 20 working days | Get Quote |
| 10 mg | 12 USD | 95 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-4081148979
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-2659321975.sdf |
| SMILES | MCULE-2659321975.smiles |
| Standard InChI | MCULE-2659321975.inchi |
| InChIKey | MCULE-2659321975.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867633420 | N/A | As is | in stock |
| P-867412533 | N/A | As is | by synthesis |
| P-869367694 | 95 | As is | in stock |
| P-590366775 | 97 | As is | in stock |
| P-901662615 | N/A | As is | in stock |
| P-596995729 | 95 | As is | 75 g |
| P-864085747 | 97 | As is | in stock |
| P-580301361 | 95 | As is | by resynthesis (? - ? days) |
| P-580278770 | 95 | As is | by resynthesis (? - ? days) |
| P-905313294 | 97 | As is | in stock |
| P-494299912 | 98 | As is | in stock |
| P-865985712 | 90 | As is | 20 mg |
| P-890221808 | 90 | As is | in stock |
| P-502468458 | 95 | As is | by synthesis |
| P-503472836 | 90 | As is | by synthesis |
| P-502596493 | 90 | As is | in stock |
| P-492218360 | 95 | As is | in stock |
| P-488548100 | 90 | As is | in stock |
| P-13595481 | 95 | As is | 300 mg |
| P-596592013 | 90 | As is | 5 g |
| P-563396765 | 97 | As is | 5 g |
| P-31258228 | 90 | As is | unavailable |
| P-901962913 | 95 | As is | 231 mg |
| P-35247121 | 90 | As is | 11.745 kg |
| P-12809262 | 90 | As is | 44 mg |
| P-454371182 | 92 | As is | in stock |
| P-13757884 | 92 | As is | 300 mg |
| P-885515503 | 95 | As is | by synthesis |
| P-19010156 | 90 | As is | in stock |
| P-896078215 | N/A | As is | 9 mg |
| P-502329049 | 90 | As is | in stock |
| P-907287141 | 94 | As is | by resynthesis (? - ? days) |
| P-22443167 | 90 | As is | 10 mg |
| P-906866970 | 95 | As is | by synthesis |
| P-611588042 | 90 | As is | in stock |
| P-464674157 | 90 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 191.183 |
| logP | 1.3389 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 66.4 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 51.6665 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 9 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
