Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7474091744
Compound
Show structures
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 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-7736335582
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7474091744.sdf |
| SMILES | MCULE-7474091744.smiles |
| Standard InChI | MCULE-7474091744.inchi |
| InChIKey | MCULE-7474091744.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903053798 | 98 | As is | 3 kg |
| P-905480203 | 97 | As is | 1000 g |
| P-489152522 | 97 | As is | in stock |
| P-895915622 | 95 | As is | by resynthesis (? - ? days) |
| P-866725131 | 95 | As is | 452.7 g |
| P-580696073 | 98 | As is | 3.785 kg |
| P-900267541 | N/A | As is | by resynthesis (? - ? days) |
| P-454646523 | 90 | As is | in stock |
| P-452652358 | 98 | As is | in stock |
| P-868628086 | 98 | As is | in stock |
| P-868648361 | 98 | As is | in stock |
| P-579478167 | 95 | As is | in stock |
| P-905359530 | 98 | As is | 525 g |
| P-905431136 | 98 | As is | 9.17542 kg |
| P-579617691 | 97 | As is | 5 kg |
| P-852465683 | N/A | As is | in stock |
| P-901019777 | 95 | As is | in stock |
| P-854691611 | 95 | As is | in stock |
| P-474023510 | 95 | As is | in stock |
| P-608276127 | 98 | As is | in stock |
| P-1263956045 | 90 | As is | in stock |
| P-579711951 | N/A | As is | in stock |
| P-895186804 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 441.397 |
| logP | 1.0003 |
| H-bond acceptors | 13 |
| H-bond donors | 6 |
| Rotatable bonds | 10 |
| PSA | 213.28 |
| RO5 violations | 2 |
| RO3 violations | 5 |
| Refractivity | 111.9186 |
| Atoms | 51 |
| Rings | 3 |
| Heavy atoms | 32 |
| Hydrogen atoms | 19 |
| Heteroatoms | 13 |
| N/O atoms | 13 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
