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DocumentationIdentifier: MM174047
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM174047 |
| SMILES |
C=CC(F)C(O)C=CF
|
| InChIKey |
PQSRLVNLCZOICH-UHFFFAOYSA-N
|
| MW [Da] |
134.13
Automatically obtained from RDkit software. |
| LogP |
1.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM111652
Similarity: 0.7282
Similarity to MM111652
| Tanimoto metric | 0.7282 |
|---|---|
| Cosine metric | 0.8533 |
| Dice metric | 0.8427 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM174046
Similarity: 0.6371
Similarity to MM174046
| Tanimoto metric | 0.6371 |
|---|---|
| Cosine metric | 0.7784 |
| Dice metric | 0.7783 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM174052
Similarity: 0.6111
Similarity to MM174052
| Tanimoto metric | 0.6111 |
|---|---|
| Cosine metric | 0.7587 |
| Dice metric | 0.7586 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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