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DocumentationIdentifier: MM280610
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM280610 |
| SMILES |
C=CC=CCC(C)C=CC
|
| InChIKey |
VFTUQFRZDFWGNM-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168321
Similarity: 0.8929
Similarity to MM168321
| Tanimoto metric | 0.8929 |
|---|---|
| Cosine metric | 0.9449 |
| Dice metric | 0.9434 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374519
Similarity: 0.8667
Similarity to MM374519
| Tanimoto metric | 0.8667 |
|---|---|
| Cosine metric | 0.9286 |
| Dice metric | 0.9286 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM157820
Similarity: 0.8621
Similarity to MM157820
| Tanimoto metric | 0.8621 |
|---|---|
| Cosine metric | 0.9266 |
| Dice metric | 0.9259 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+628 more
