Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7087323724-0
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 | 24 USD | N/A | 9 working days | Get Quote |
| 5 mg | 24 USD | N/A | 9 working days | Get Quote |
| 10 mg | 24 USD | N/A | 9 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-7087323724-0.sdf |
| SMILES | MCULE-7087323724-0.smiles |
| Standard InChI | MCULE-7087323724-0.inchi |
| InChIKey | MCULE-7087323724-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852072153 | N/A | As is | by synthesis |
| P-852150081 | 97 | As is | by synthesis |
| P-874647115 | 97 | As is | by resynthesis (? - ? days) |
| P-1275542925 | 90 | As is | by synthesis |
| P-896060588 | N/A | As is | in stock |
| P-865932570 | 97 | As is | unavailable |
| P-895947297 | 95 | As is | by resynthesis (? - ? days) |
| P-864285900 | 98 | As is | by synthesis |
| P-893247689 | 95 | As is | by synthesis |
| P-34867374 | 90 | As is | in stock |
| P-580430468 | 95 | As is | by resynthesis (? - ? days) |
| P-575334726 | 95 | As is | in stock |
| P-862133891 | 95 | As is | 300 g |
| P-492239444 | 95 | As is | in stock |
| P-502590903 | 90 | As is | in stock |
| P-596568228 | 97 | As is | 5 g |
| P-596600505 | 97 | As is | 10 g |
| P-14084408 | 90 | As is | 5 mg |
| P-621082065 | 90 | As is | by synthesis |
| P-424805217 | 90 | As is | in stock |
| P-596766118 | 95 | As is | 180 g |
| P-22642418 | 90 | As is | in stock |
| P-888440848 | 94 | As is | by resynthesis (? - ? days) |
| P-422102 | 90 | As is | 116 mg |
| P-1271680190 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 220.315 |
| logP | 3.7057 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 73.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 62.0025 |
| Atoms | 22 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 3 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
