Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9198907003
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 | 6 USD | 98 | 22 working days | Get Quote |
| 5 mg | 19 USD | 98 | 22 working days | Get Quote |
| 10 mg | 36 USD | 98 | 15 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-9198907003.sdf |
| SMILES | MCULE-9198907003.smiles |
| Standard InChI | MCULE-9198907003.inchi |
| InChIKey | MCULE-9198907003.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867540421 | 98 | As is | in stock |
| P-875696705 | N/A | As is | in stock |
| P-874640105 | 98 | As is | in stock |
| P-903019508 | 98 | As is | 10 mg |
| P-1264047694 | 95 | As is | in stock |
| P-610975023 | 90 | As is | 6.027 g |
| P-606850756 | N/A | As is | in stock |
| P-489235045 | 97 | As is | in stock |
| P-596937911 | N/A | As is | 30 mg |
| P-872724133 | 98 | As is | in stock |
| P-901337215 | 95 | As is | by synthesis |
| P-860056327 | 98 | As is | by synthesis |
| P-590616806 | 98 | As is | 210 mg |
| P-893255969 | 95 | As is | by synthesis |
| P-851279900 | 95 | As is | by synthesis |
| P-860798708 | 98 | As is | in stock |
| P-861490719 | 95 | As is | by synthesis |
| P-579479077 | 95 | As is | in stock |
| P-580333461 | 95 | As is | by resynthesis (? - ? days) |
| P-868078773 | 95 | As is | in stock |
| P-596575923 | 97 | As is | 10 mg |
| P-35249519 | 90 | As is | 160 g |
| P-854711697 | 95 | As is | in stock |
| P-474024789 | 95 | As is | in stock |
| P-608271092 | 98 | As is | in stock |
| P-500411003 | 98 | As is | by synthesis |
| P-885549305 | 95 | As is | by synthesis |
| P-851361518 | 98 | As is | 16.77 g |
| P-886921819 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 302.106 |
| logP | 3.1901 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 90.39 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 71.6298 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 9 |
| Heteroatoms | 7 |
| N/O atoms | 5 |
| 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 |
