Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5659573566-0
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 | 34 USD | 90 | 23 working days | Get Quote |
| 5 mg | 55 USD | 90 | 23 working days | Get Quote |
| 10 mg | 66 USD | 95 | 14 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.
| Name | File |
|---|---|
| SDF | MCULE-5659573566-0.sdf |
| SMILES | MCULE-5659573566-0.smiles |
| Standard InChI | MCULE-5659573566-0.inchi |
| InChIKey | MCULE-5659573566-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867550928 | 95 | As is | in stock |
| P-875708743 | N/A | As is | in stock |
| P-613849358 | 95 | As is | in stock |
| P-903034763 | 95 | As is | 5 g |
| P-851876791 | N/A | As is | by synthesis |
| P-901347757 | 95 | As is | by synthesis |
| P-591150727 | 95 | As is | by synthesis |
| P-492247861 | 90 | As is | in stock |
| P-454757155 | 90 | As is | in stock |
| P-454679640 | 90 | As is | in stock |
| P-449242170 | 90 | As is | 125 mg |
| P-436441297 | 90 | As is | unavailable |
| P-143390 | 90 | As is | 682 mg |
| P-436447156 | 95 | As is | 10 g |
| P-578613253 | 90 | As is | in stock |
| P-20013948 | 90 | As is | in stock |
| P-868633483 | 97 | As is | in stock |
| P-34804295 | 90 | As is | by synthesis |
| P-580776879 | 90 | As is | by resynthesis (? - ? days) |
| P-580766221 | 90 | As is | in stock |
| P-864499142 | 90 | As is | in stock |
| P-579799013 | 90 | As is | in stock |
| P-580088775 | 95 | As is | 7.86 g |
| P-502967602 | 90 | As is | in stock |
| P-492246297 | 95 | As is | in stock |
| P-488547740 | 90 | As is | in stock |
| P-13738991 | 92 | As is | 300 mg |
| P-596590607 | 90 | As is | 5 g |
| P-892814998 | 95 | As is | by synthesis |
| P-580489981 | N/A | As is | by synthesis |
| P-852397472 | N/A | As is | in stock |
| P-901573225 | 95 | As is | in stock |
| P-492280283 | 95 | As is | 7.86 g |
| P-34031070 | 90 | As is | 7.86 g |
| P-454371059 | 92 | As is | in stock |
| P-856065417 | 95 | As is | in stock |
| P-18878174 | 90 | As is | in stock |
| P-502327074 | 90 | As is | in stock |
| P-22478145 | 90 | As is | 120 mg |
| P-611377103 | 90 | As is | in stock |
| P-3243548 | 90 | As is | 3.938 g |
| P-3235265 | 90 | As is | 3.938 g |
| P-887547 | 90 | As is | 3.938 g |
| P-893670111 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 246.686 |
| logP | 3.7315 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 67.8185 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
