Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9147144469
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 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.
| Name | File |
|---|---|
| SDF | MCULE-9147144469.sdf |
| SMILES | MCULE-9147144469.smiles |
| Standard InChI | MCULE-9147144469.inchi |
| InChIKey | MCULE-9147144469.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867552695 | 98 | As is | in stock |
| P-875710911 | N/A | As is | in stock |
| P-869185942 | 95 | As is | in stock |
| P-505347641 | 98 | As is | in stock |
| P-903037725 | 98 | As is | 4.5 kg |
| P-901168610 | 98 | As is | in stock |
| P-580245267 | 95 | As is | by synthesis |
| P-606851620 | N/A | As is | in stock |
| P-489198436 | 97 | As is | in stock |
| P-596942186 | 98 | As is | 10 kg |
| P-589664556 | 95 | As is | by resynthesis (? - ? days) |
| P-864108060 | 95 | As is | in stock |
| P-580706076 | 98 | As is | 1.298 kg |
| P-893253776 | 95 | As is | by synthesis |
| P-619846833 | 90 | As is | 59 mg |
| P-851271831 | 95 | As is | by synthesis |
| P-868622373 | 98 | As is | in stock |
| P-861297538 | 90 | As is | by synthesis |
| P-580814454 | 90 | As is | by resynthesis (? - ? days) |
| P-605203298 | 90 | As is | in stock |
| P-580298107 | 95 | As is | by resynthesis (? - ? days) |
| P-905344408 | 97 | As is | 539 g |
| P-862023932 | 97 | As is | 539 g |
| P-888312823 | N/A | As is | in stock |
| P-890216584 | 90 | As is | 1000 mg |
| P-590339017 | 90 | As is | 1000 mg |
| P-505545774 | 95 | As is | in stock |
| P-855992048 | 98 | As is | 100 mg |
| P-524161746 | 98 | As is | 100 g |
| P-615646415 | 95 | As is | in stock |
| P-579621599 | 95 | As is | unavailable |
| P-131197009 | 90 | As is | 428 mg |
| P-468068733 | 95 | As is | 428 mg |
| P-611663223 | 97 | As is | by synthesis |
| P-852505307 | N/A | As is | in stock |
| P-904720837 | 90 | As is | in stock |
| P-854747492 | 95 | As is | in stock |
| P-888902837 | N/A | As is | in stock |
| P-491417443 | 95 | As is | by synthesis |
| P-868149755 | 90 | As is | in stock |
| P-596762068 | 97 | As is | 1.2825 kg |
| P-906899726 | 98 | As is | in stock |
| P-906788908 | 98 | As is | by synthesis |
| P-906828111 | 96 | As is | by synthesis |
| P-906812534 | 98 | As is | by synthesis |
| P-906827169 | 98 | As is | by synthesis |
| P-611472936 | 90 | As is | in stock |
| P-855365998 | 90 | As is | in stock |
| P-863617645 | 90 | As is | 105 mg |
| P-893948948 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 176.121 |
| logP | 1.0559 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 35.5163 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 6 |
| Heteroatoms | 6 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
