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DocumentationIdentifier: MM198798
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM198798 |
| SMILES |
C=CC(CF)CCCF
|
| InChIKey |
SORORXBKVVAZPA-UHFFFAOYSA-N
|
| MW [Da] |
134.17
Automatically obtained from RDkit software. |
| LogP |
2.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM198924
Similarity: 0.8406
Similarity to MM198924
| Tanimoto metric | 0.8406 |
|---|---|
| Cosine metric | 0.9134 |
| Dice metric | 0.9134 |
| MW: | 128.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM339925
Similarity: 0.8101
Similarity to MM339925
| Tanimoto metric | 0.8101 |
|---|---|
| Cosine metric | 0.9001 |
| Dice metric | 0.8951 |
| MW: | 152.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326976
Similarity: 0.8
Similarity to MM326976
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8901 |
| Dice metric | 0.8889 |
| MW: | 142.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+689 more
