Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-3637137388-0
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 | 6 USD | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 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-1488104822-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-3637137388-0.sdf |
| SMILES | MCULE-3637137388-0.smiles |
| Standard InChI | MCULE-3637137388-0.inchi |
| InChIKey | MCULE-3637137388-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867569242 | 98 | As is | in stock |
| P-875729031 | 98 | As is | in stock |
| P-580192469 | 98 | As is | in stock |
| P-1270396534 | 99 | As is | in stock |
| P-580243619 | 95 | As is | by synthesis |
| P-606913718 | N/A | As is | in stock |
| P-596948482 | 98 | As is | 1000 g |
| P-864107692 | 95 | As is | in stock |
| P-893242619 | 95 | As is | in stock |
| P-607680704 | 90 | As is | 33 mg |
| P-488555398 | 92 | As is | in stock |
| P-869107711 | 95 | As is | 1.533 g |
| P-892286311 | 95 | As is | 4.633 g |
| P-888626748 | 95 | As is | 4.633 g |
| P-1271648301 | 98 | As is | in stock |
| P-867586882 | 98 | As a main component | in stock |
| P-875745558 | 95 | As a main component | in stock |
| P-1270270394 | 97 | As a main component | in stock |
| P-580241369 | 95 | As a main component | by synthesis |
| P-606951038 | N/A | As a main component | in stock |
| P-596931641 | 99 | As a main component | 1000 g |
| P-864085828 | 97 | As a main component | in stock |
| P-868545636 | 99 | As a main component | in stock |
| P-893219105 | 95 | As a main component | in stock |
| P-893242794 | 95 | As a main component | in stock |
| P-869161849 | 95 | As a main component | 1.502 g |
| P-892296692 | 95 | As a main component | 1.237 g |
| P-888657235 | 95 | As a main component | 1.237 g |
| P-893943740 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 263.198 |
| logP | -0.7074 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 110.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 54.826 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 11 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
