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DocumentationIdentifier: MM331702
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM331702 |
| SMILES |
CC=C(CC(F)CO)OC
|
| InChIKey |
NLNWXTRSILPYHI-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142016
Similarity: 0.7197
Similarity to MM142016
| Tanimoto metric | 0.7197 |
|---|---|
| Cosine metric | 0.8483 |
| Dice metric | 0.837 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM331698
Similarity: 0.6582
Similarity to MM331698
| Tanimoto metric | 0.6582 |
|---|---|
| Cosine metric | 0.7939 |
| Dice metric | 0.7939 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224354
Similarity: 0.642
Similarity to MM224354
| Tanimoto metric | 0.642 |
|---|---|
| Cosine metric | 0.782 |
| Dice metric | 0.782 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+164 more
