Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2673263383
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 | 93 USD | 97 | 22 working days | Get Quote |
| 5 mg | 93 USD | 97 | 22 working days | Get Quote |
| 10 mg | 93 USD | 97 | 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.
| Name | File |
|---|---|
| SDF | MCULE-2673263383.sdf |
| SMILES | MCULE-2673263383.smiles |
| Standard InChI | MCULE-2673263383.inchi |
| InChIKey | MCULE-2673263383.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1270126286 | 97 | As is | in stock |
| P-1268828815 | 97 | As is | in stock |
| P-894662419 | 95 | As is | by resynthesis (? - ? days) |
| P-903168206 | 97 | As is | 1000 mg |
| P-610965032 | 90 | As is | 4.07 g |
| P-1270276467 | 95 | As is | in stock |
| P-851753687 | N/A | As is | by synthesis |
| P-873296099 | 97 | As is | 400 mg |
| P-1273473749 | 95 | As is | by resynthesis (? - ? days) |
| P-889776932 | 95 | As is | in stock |
| P-590938272 | 95 | As is | by synthesis |
| P-887171237 | 95 | As is | by synthesis |
| P-889290725 | 97 | As is | 1.67 g |
| P-1273121137 | 97 | As is | 2.5 g |
| P-1263151988 | 95 | As is | in stock |
| P-886895948 | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 232.707 |
| logP | 3.9304 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 38.91 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 68.5894 |
| Atoms | 29 |
| Rings | 3 |
| Heavy atoms | 16 |
| Hydrogen atoms | 13 |
| 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 |
