Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6633895173-0
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 | 6 USD | 96 | 14 working days | Get Quote |
| 5 mg | 6 USD | 96 | 14 working days | Get Quote |
| 10 mg | 6 USD | 96 | 14 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-6633895173-0.sdf |
| SMILES | MCULE-6633895173-0.smiles |
| Standard InChI | MCULE-6633895173-0.inchi |
| InChIKey | MCULE-6633895173-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867538586 | 96 | As is | in stock |
| P-875693962 | N/A | As is | in stock |
| P-1275156490 | 95 | As is | in stock |
| P-1275201518 | 98 | As is | in stock |
| P-903015590 | 96 | As is | 800 g |
| P-1270341221 | 96 | As is | in stock |
| P-596937160 | N/A | As is | 900 g |
| P-864206271 | 95 | As is | in stock |
| P-666960040 | 96 | As is | 1000 g |
| P-893237406 | 95 | As is | in stock |
| P-10023260 | 90 | As is | 62 mg |
| P-34866883 | 90 | As is | in stock |
| P-868611424 | 96 | As is | in stock |
| P-901409064 | 95 | As is | 900 g |
| P-905326691 | 95 | As is | 50 g |
| P-608220954 | N/A | As is | in stock |
| P-870663281 | 95 | As is | in stock |
| P-854062960 | 90 | As is | in stock |
| P-524169715 | 98 | As is | 100 g |
| P-856006401 | 98 | As is | 100 mg |
| P-579624033 | 95 | As is | in stock |
| P-856045837 | 90 | As is | unavailable |
| P-31177378 | 90 | As is | unavailable |
| P-588253749 | N/A | As is | by synthesis |
| P-852606723 | N/A | As is | by synthesis |
| P-1271845306 | 95 | As is | in stock |
| P-621084079 | 90 | As is | by synthesis |
| P-885522687 | 95 | As is | by synthesis |
| P-424805093 | 90 | As is | in stock |
| P-502333058 | 90 | As is | in stock |
| P-22449589 | 90 | As is | 98 mg |
| P-611512079 | 90 | As is | in stock |
| P-3217759 | 90 | As is | 3.256 g |
| P-434024 | 90 | As is | 3.256 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 430.534 |
| logP | 6.4237 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 66.76 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 127.7615 |
| Atoms | 62 |
| Rings | 4 |
| Heavy atoms | 32 |
| Hydrogen atoms | 30 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
