Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9870409973-0
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 | 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 |
- 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-9870409973-0.sdf |
| SMILES | MCULE-9870409973-0.smiles |
| Standard InChI | MCULE-9870409973-0.inchi |
| InChIKey | MCULE-9870409973-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867558506 | 97 | As is | in stock |
| P-875717701 | 97 | As is | in stock |
| P-1275145742 | 95 | As is | in stock |
| P-1275178601 | 98 | As is | in stock |
| P-903046378 | 98 | As is | 12 kg |
| P-1270315190 | 97 | As is | in stock |
| P-606944292 | N/A | As is | in stock |
| P-489152624 | 97 | As is | in stock |
| P-596944242 | 97 | As is | 24 kg |
| P-494351712 | 95 | As is | 229 g |
| P-864188011 | 95 | As is | in stock |
| P-580709911 | 97 | As is | 2.1 kg |
| P-901455689 | 95 | As is | by synthesis |
| P-868614047 | 97 | As is | in stock |
| P-1264351338 | 97 | As is | 225 g |
| P-862029035 | 97 | As is | 47.9266 kg |
| P-870653914 | N/A | As is | in stock |
| P-502484119 | 95 | As is | by synthesis |
| P-488550738 | 90 | As is | in stock |
| P-12702645 | 92 | As is | 300 mg |
| P-454408233 | 95 | As is | 959.85 g |
| P-454332193 | 95 | As is | 100 mg |
| P-31138743 | 90 | As is | unavailable |
| P-613282177 | 95 | As is | by synthesis |
| P-1272596363 | 95 | As is | 5 kg |
| P-852510667 | 95 | As is | by synthesis |
| P-854737669 | 95 | As is | in stock |
| P-492278742 | 95 | As is | 2.4 g |
| P-12632389 | 90 | As is | 2.4 g |
| P-888903016 | N/A | As is | in stock |
| P-454369034 | 92 | As is | in stock |
| P-23802410 | 92 | As is | 300 mg |
| P-500404749 | 98 | As is | by synthesis |
| P-885517095 | 95 | As is | by synthesis |
| P-519835799 | 90 | As is | in stock |
| P-498679117 | 97 | As is | 46.1549 kg |
| P-906779054 | 98 | As is | by synthesis |
| P-1617995 | 90 | As is | 1.105 g |
| P-1271639023 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 128.129 |
| logP | 0.262 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 58.2 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 38.2954 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 8 |
| 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 |
