Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM226812
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM226812 |
| SMILES |
CCC(C)(C)OC(=O)CF
|
| InChIKey |
KXTLQHNHHBVIHD-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142079
Similarity: 0.7876
Similarity to MM142079
| Tanimoto metric | 0.7876 |
|---|---|
| Cosine metric | 0.8875 |
| Dice metric | 0.8812 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM130799
Similarity: 0.7434
Similarity to MM130799
| Tanimoto metric | 0.7434 |
|---|---|
| Cosine metric | 0.8622 |
| Dice metric | 0.8528 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328759
Similarity: 0.7295
Similarity to MM328759
| Tanimoto metric | 0.7295 |
|---|---|
| Cosine metric | 0.8457 |
| Dice metric | 0.8436 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+170 more
