Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9204004625
Compound
Show structures
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 | 9 USD | 97 | 14 working days | Get Quote |
| 5 mg | 9 USD | 97 | 14 working days | Get Quote |
| 10 mg | 9 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-9204004625.sdf |
| SMILES | MCULE-9204004625.smiles |
| Standard InChI | MCULE-9204004625.inchi |
| InChIKey | MCULE-9204004625.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867597472 | 97 | As is | in stock |
| P-875757365 | 97 | As is | in stock |
| P-590386898 | 97 | As is | by resynthesis (? - ? days) |
| P-903091369 | 97 | As is | 125 g |
| P-893577100 | 90 | As is | 107.522 g |
| P-1270336398 | 97 | As is | in stock |
| P-856057747 | 95 | As is | by synthesis |
| P-606914677 | N/A | As is | in stock |
| P-489202267 | 97 | As is | in stock |
| P-596958723 | 97 | As is | 30 g |
| P-589664508 | 95 | As is | by resynthesis (? - ? days) |
| P-864170111 | 97 | As is | in stock |
| P-580710840 | 97 | As is | 350 mg |
| P-868590832 | 98 | As is | in stock |
| P-905341992 | 97 | As is | 10 g |
| P-862016682 | 97 | As is | 48.572 g |
| P-524188883 | 97 | As is | 1000 mg |
| P-874467172 | 95 | As is | by synthesis |
| P-1279067411 | N/A | As is | by synthesis |
| P-1279662937 | N/A | As is | in stock |
| P-863701141 | 95 | As is | in stock |
| P-491202741 | 95 | As is | by synthesis |
| P-596772338 | 97 | As is | 101.5 g |
| P-611385063 | 90 | As is | in stock |
| P-615650362 | 95 | As is | unavailable |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 163.148 |
| logP | 1.6672 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 32.86 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 44.5267 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 6 |
| 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 |
