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DocumentationIdentifier: MM329467
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM329467 |
| SMILES |
O=CC(CF)OC(=O)CF
|
| InChIKey |
YSMIHOQPFYGRIN-UHFFFAOYSA-N
|
| MW [Da] |
152.1
Automatically obtained from RDkit software. |
| LogP |
0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM150056
Similarity: 0.8291
Similarity to MM150056
| Tanimoto metric | 0.8291 |
|---|---|
| Cosine metric | 0.9105 |
| Dice metric | 0.9065 |
| MW: | 134.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142083
Similarity: 0.7009
Similarity to MM142083
| Tanimoto metric | 0.7009 |
|---|---|
| Cosine metric | 0.8372 |
| Dice metric | 0.8241 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329465
Similarity: 0.6736
Similarity to MM329465
| Tanimoto metric | 0.6736 |
|---|---|
| Cosine metric | 0.8053 |
| Dice metric | 0.805 |
| MW: | 150.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+112 more
