Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6734536219
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 | 7 USD | 99 | 14 working days | Get Quote |
| 5 mg | 13 USD | 99 | 20 working days | Get Quote |
| 10 mg | 13 USD | 99 | 20 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-6734536219.sdf |
| SMILES | MCULE-6734536219.smiles |
| Standard InChI | MCULE-6734536219.inchi |
| InChIKey | MCULE-6734536219.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867540096 | 98 | As is | in stock |
| P-875696215 | 98 | As is | in stock |
| P-597027396 | 95 | As is | unavailable |
| P-1275179476 | 98 | As is | in stock |
| P-1275183859 | 95 | As is | in stock |
| P-580194875 | 98 | As is | in stock |
| P-903018737 | 99 | As is | 30 g |
| P-1264048468 | 99 | As is | in stock |
| P-1270303997 | 99 | As is | in stock |
| P-675239532 | 98 | As is | in stock |
| P-606925994 | N/A | As is | in stock |
| P-489133838 | 97 | As is | in stock |
| P-596937824 | 99 | As is | 100 g |
| P-1273457182 | 95 | As is | by resynthesis (? - ? days) |
| P-864085813 | 95 | As is | in stock |
| P-900155220 | 98 | As is | in stock |
| P-893219201 | 95 | As is | in stock |
| P-893232632 | 95 | As is | in stock |
| P-505572571 | 98 | As is | in stock |
| P-851278208 | 95 | As is | by synthesis |
| P-579476565 | 95 | As is | in stock |
| P-580290441 | N/A | As is | by resynthesis (? - ? days) |
| P-861958094 | 99 | As is | 30 g |
| P-870652628 | 98 | As is | in stock |
| P-505491675 | 95 | As is | in stock |
| P-575366104 | 95 | As is | 100 mg |
| P-580501896 | 95 | As is | by synthesis |
| P-1272581802 | 95 | As is | 50 mg |
| P-852444585 | 95 | As is | by synthesis |
| P-854716049 | 95 | As is | in stock |
| P-899992872 | 95 | As is | in stock |
| P-584620900 | 95 | As is | in stock |
| P-608271069 | 98 | As is | in stock |
| P-500374462 | 98 | As is | by synthesis |
| P-885543750 | 95 | As is | by synthesis |
| P-579710473 | 98 | As is | in stock |
| P-464633222 | 95 | As is | 793 mg |
| P-892289314 | 95 | As is | 793 mg |
| P-888634805 | 95 | As is | 793 mg |
| P-611466975 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 233.694 |
| logP | 2.6418 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 6 |
| PSA | 61.77 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 59.0837 |
| Atoms | 31 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 16 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
