Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM388681
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM388681 |
| SMILES |
C=C(C)C(C#N)C(C)CF
|
| InChIKey |
VCJFBTWETOHTBK-UHFFFAOYSA-N
|
| MW [Da] |
141.19
Automatically obtained from RDkit software. |
| LogP |
2.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM52276
Similarity: 0.7244
Similarity to MM52276
| Tanimoto metric | 0.7244 |
|---|---|
| Cosine metric | 0.8511 |
| Dice metric | 0.8402 |
| MW: | 127.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160087
Similarity: 0.6614
Similarity to MM160087
| Tanimoto metric | 0.6614 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.7962 |
| MW: | 130.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297706
Similarity: 0.6159
Similarity to MM297706
| Tanimoto metric | 0.6159 |
|---|---|
| Cosine metric | 0.7698 |
| Dice metric | 0.7623 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+177 more
