Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6238103473
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 | 47 USD | 90 | 21 working days | Get Quote |
| 5 mg | 76 USD | 90 | 21 working days | Get Quote |
| 10 mg | 91 USD | 90 | 21 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-6238103473.sdf |
| SMILES | MCULE-6238103473.smiles |
| Standard InChI | MCULE-6238103473.inchi |
| InChIKey | MCULE-6238103473.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266341098 | 98 | As is | in stock |
| P-901320552 | 98 | As is | in stock |
| P-903460367 | 98 | As is | 14 g |
| P-1270360103 | 98 | As is | in stock |
| P-1264203340 | N/A | As is | by synthesis |
| P-900254535 | 98 | As is | 14 g |
| P-1273408645 | 95 | As is | by resynthesis (? - ? days) |
| P-889785217 | 95 | As is | in stock |
| P-1264193753 | 98 | As is | by synthesis |
| P-6197456 | 90 | As is | 10 mg |
| P-1263256003 | 95 | As is | by synthesis |
| P-1273130770 | 98 | As is | 19.35 g |
| P-1275086475 | 97 | As is | 100 mg |
| P-12827214 | 90 | As is | 820 mg |
| P-906859123 | 98 | As is | by synthesis |
| P-1279250790 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 334.795 |
| logP | 2.7536 |
| H-bond acceptors | 5 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 49.85 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 95.837 |
| Atoms | 42 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 19 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
