Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6552510632
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 | 20 USD | 99 | 20 working days | Get Quote |
| 5 mg | 20 USD | 99 | 20 working days | Get Quote |
| 10 mg | 20 USD | 99 | 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.
-
1
MCULE-4269934057
- Component type: Main
-
1
MCULE-6572487779
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6552510632.sdf |
| SMILES | MCULE-6552510632.smiles |
| Standard InChI | MCULE-6552510632.inchi |
| InChIKey | MCULE-6552510632.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-869321470 | 95 | As is | in stock |
| P-1264047005 | 95 | As is | in stock |
| P-893568340 | 90 | As is | 11.1 g |
| P-580195242 | 98 | As is | in stock |
| P-864217188 | 95 | As is | by synthesis |
| P-900155096 | 98 | As is | in stock |
| P-868545242 | 99 | As is | in stock |
| P-871219010 | N/A | As is | by resynthesis (? - ? days) |
| P-893221184 | 95 | As is | in stock |
| P-871218212 | 95 | As is | 11 g |
| P-860798762 | 98 | As is | in stock |
| P-861517816 | 95 | As is | by synthesis |
| P-579478593 | 95 | As is | in stock |
| P-868078670 | 95 | As is | in stock |
| P-608270547 | 98 | As is | in stock |
| P-608277086 | 98 | As is | in stock |
| P-579710759 | N/A | As is | in stock |
| P-611490381 | 90 | As is | in stock |
| P-855344610 | 90 | As is | in stock |
| P-1264052977 | 95 | Main component | in stock |
| P-907500832 | 90 | Main component | by synthesis |
| P-606853997 | N/A | Main component | in stock |
| P-864262213 | 98 | Main component | by synthesis |
| P-617552222 | 98 | Main component | by synthesis |
| P-580717432 | 99 | Main component | 1.978 g |
| P-901422598 | 95 | Main component | by synthesis |
| P-861511923 | 95 | Main component | by synthesis |
| P-505543452 | 95 | Main component | in stock |
| P-524198360 | 97 | Main component | 250 mg |
| P-852520949 | N/A | Main component | in stock |
| P-617402704 | N/A | Main component | in stock |
| P-890161335 | N/A | Main component as a main component | in stock |
| P-903171837 | 95 | Main component as a main component | 25 g |
| P-895102170 | 99 | Main component as a main component | 2.5 kg |
| P-895473242 | 95 | Main component as a main component | by synthesis |
| P-904223199 | 95 | Main component as a main component | by synthesis |
| P-904239287 | 95 | Main component as a main component | unavailable |
| P-854976377 | 90 | Main component as a main component | in stock |
| P-854976389 | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 493.580 |
| logP | 5.40718 |
| H-bond acceptors | 9 |
| H-bond donors | 3 |
| Rotatable bonds | 7 |
| PSA | 153.45 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 134.0147 |
| Atoms | 62 |
| Rings | 4 |
| Heavy atoms | 35 |
| Hydrogen atoms | 27 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| 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 |
