Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1675686185
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 | 6 USD | 99 | 14 working days | Get Quote |
| 5 mg | 6 USD | 99 | 14 working days | Get Quote |
| 10 mg | 6 USD | 99 | 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-9308852983
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1675686185.sdf |
| SMILES | MCULE-1675686185.smiles |
| Standard InChI | MCULE-1675686185.inchi |
| InChIKey | MCULE-1675686185.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867570683 | 98 | As is | in stock |
| P-875731304 | 98 | As is | in stock |
| P-1275194294 | 97 | As is | in stock |
| P-1275149030 | 95 | As is | in stock |
| P-903060518 | 99 | As is | 700 g |
| P-617064771 | 99 | As is | in stock |
| P-851946145 | N/A | As is | in stock |
| P-489123369 | 97 | As is | in stock |
| P-596949474 | 98 | As is | 2.4 kg |
| P-1273463523 | 95 | As is | by resynthesis (? - ? days) |
| P-864193134 | 95 | As is | in stock |
| P-868603270 | 97 | As is | in stock |
| P-580417246 | 95 | As is | by resynthesis (? - ? days) |
| P-901380162 | 98 | As is | 4 g |
| P-905338950 | 98 | As is | 35 g |
| P-862000295 | 98 | As is | 9.06998 kg |
| P-588709131 | 97 | As is | unavailable |
| P-855925393 | 95 | As is | 1000 mg |
| P-454412184 | 95 | As is | 200 g |
| P-855995530 | 95 | As is | 100 mg |
| P-860788370 | N/A | As is | by synthesis |
| P-1279661205 | N/A | As is | in stock |
| P-1279064765 | N/A | As is | by synthesis |
| P-852504961 | N/A | As is | by synthesis |
| P-863721244 | 95 | As is | in stock |
| P-888888600 | N/A | As is | in stock |
| P-500410846 | 95 | As is | by synthesis |
| P-885544046 | 95 | As is | by synthesis |
| P-33209575 | 90 | As is | in stock |
| P-906769430 | 98 | As is | by synthesis |
| P-611392041 | 90 | As is | in stock |
| P-1271639215 | 98 | As is | in stock |
| P-855966041 | 95 | As a main component | 1000 mg |
| P-596572784 | 97 | As a main component | 1000 mg |
| P-870640498 | 97 | As a main component | 100 mg |
| P-852531292 | N/A | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 114.189 |
| logP | 1.6156 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 52.04 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 34.2568 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 8 |
| Hydrogen atoms | 14 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
