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DocumentationIdentifier: MM265954
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265954 |
| SMILES |
C=CC=C(F)CC(=C)CN
|
| InChIKey |
MUAUBHQNTAKZFR-UHFFFAOYSA-N
|
| MW [Da] |
141.19
Automatically obtained from RDkit software. |
| LogP |
1.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM72192
Similarity: 0.8305
Similarity to MM72192
| Tanimoto metric | 0.8305 |
|---|---|
| Cosine metric | 0.9113 |
| Dice metric | 0.9074 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265802
Similarity: 0.7846
Similarity to MM265802
| Tanimoto metric | 0.7846 |
|---|---|
| Cosine metric | 0.8794 |
| Dice metric | 0.8793 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265803
Similarity: 0.7206
Similarity to MM265803
| Tanimoto metric | 0.7206 |
|---|---|
| Cosine metric | 0.8376 |
| Dice metric | 0.8376 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+208 more
