Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9309817841-0
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 | 8 USD | 99 | 22 working days | Get Quote |
| 5 mg | 13 USD | 99 | 22 working days | Get Quote |
| 10 mg | 19 USD | 99 | 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-9309817841-0.sdf |
| SMILES | MCULE-9309817841-0.smiles |
| Standard InChI | MCULE-9309817841-0.inchi |
| InChIKey | MCULE-9309817841-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867553970 | 98 | As is | in stock |
| P-867620498 | 99 | As is | in stock |
| P-590359474 | 98 | As is | in stock |
| P-869196704 | 95 | As is | in stock |
| P-505401956 | 95 | As is | in stock |
| P-610960915 | 90 | As is | 87.023 g |
| P-893606804 | 90 | As is | 899 mg |
| P-851924046 | N/A | As is | by synthesis |
| P-606842126 | N/A | As is | in stock |
| P-606882179 | N/A | As is | in stock |
| P-596942603 | 98 | As is | 2 g |
| P-596964339 | 99 | As is | 500 mg |
| P-580192984 | 98 | As is | in stock |
| P-864217678 | 95 | As is | by synthesis |
| P-864139970 | 97 | As is | in stock |
| P-893228252 | 95 | As is | in stock |
| P-860798743 | 98 | As is | in stock |
| P-580452628 | 98 | As is | in stock |
| P-870660203 | N/A | As is | in stock |
| P-890220110 | 90 | As is | in stock |
| P-590345316 | 90 | As is | 16 g |
| P-505539388 | 95 | As is | in stock |
| P-868078812 | 95 | As is | in stock |
| P-524439913 | 97 | As is | 33.347 g |
| P-615657801 | 95 | As is | in stock |
| P-878262784 | 98 | As is | in stock |
| P-491319092 | 95 | As is | by synthesis |
| P-579711292 | N/A | As is | in stock |
| P-869125722 | 95 | As is | by synthesis |
| P-464640334 | 95 | As is | by synthesis |
| P-892292056 | 95 | As is | unavailable |
| P-892290778 | 95 | As is | unavailable |
| P-888639241 | 95 | As is | 186 mg |
| P-888643046 | 95 | As is | 102 mg |
| P-893949332 | 95 | As is | in stock |
| P-575302130 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 238.284 |
| logP | 3.2622 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 44.89 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 76.4214 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
