Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-8919412541-0
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 | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 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-8919412541-0.sdf |
| SMILES | MCULE-8919412541-0.smiles |
| Standard InChI | MCULE-8919412541-0.inchi |
| InChIKey | MCULE-8919412541-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867584134 | 98 | As is | in stock |
| P-875742551 | N/A | As is | in stock |
| P-579761394 | 97 | As is | in stock |
| P-903072697 | 98 | As is | 2.5 kg |
| P-905481364 | 95 | As is | 100 g |
| P-606844467 | N/A | As is | in stock |
| P-489146806 | 97 | As is | in stock |
| P-596931435 | 98 | As is | 2.5 kg |
| P-866729234 | 95 | As is | 20 g |
| P-596508836 | 90 | As is | 72 mg |
| P-596285622 | 90 | As is | 72 mg |
| P-864139716 | 97 | As is | in stock |
| P-580705902 | 98 | As is | 630 g |
| P-901415541 | 95 | As is | in stock |
| P-19949362 | 90 | As is | in stock |
| P-34455907 | 90 | As is | in stock |
| P-580402182 | 95 | As is | by resynthesis (? - ? days) |
| P-905414334 | 98 | As is | 485.147 g |
| P-494300659 | 98 | As is | in stock |
| P-505522296 | 95 | As is | in stock |
| P-503624788 | 90 | As is | by synthesis |
| P-502616560 | 90 | As is | in stock |
| P-492236044 | 95 | As is | in stock |
| P-855992773 | 98 | As is | 100 mg |
| P-524164977 | 98 | As is | 500 g |
| P-855926901 | 97 | As is | 100 g |
| P-579660059 | 95 | As is | by resynthesis (? - ? days) |
| P-35205898 | 97 | As is | 992 g |
| P-854751099 | 95 | As is | in stock |
| P-617692949 | 95 | As is | 133 mg |
| P-424127388 | 90 | As is | 133 mg |
| P-500405865 | 98 | As is | by synthesis |
| P-491348826 | 95 | As is | by synthesis |
| P-19281252 | 90 | As is | in stock |
| P-596751586 | 95 | As is | 1.66 kg |
| P-502332748 | 90 | As is | in stock |
| P-22526965 | 90 | As is | 999 mg |
| P-906771841 | 98 | As is | by synthesis |
| P-906771910 | 98 | As is | by synthesis |
| P-611387243 | 90 | As is | in stock |
| P-3230573 | 90 | As is | 624 mg |
| P-25600352 | 90 | As is | 624 mg |
| P-3240441 | 90 | As is | 624 mg |
| P-575297640 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 182.173 |
| logP | 0.5939 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 74.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 44.2186 |
| Atoms | 23 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 4 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 4 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
