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DocumentationIdentifier: MM293910
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293910 |
| SMILES |
C=CCC(=C)C(=C)CCC
|
| InChIKey |
STSHSCURJBTTKP-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173669
Similarity: 0.8696
Similarity to MM173669
| Tanimoto metric | 0.8696 |
|---|---|
| Cosine metric | 0.9325 |
| Dice metric | 0.9302 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246773
Similarity: 0.8354
Similarity to MM246773
| Tanimoto metric | 0.8354 |
|---|---|
| Cosine metric | 0.9114 |
| Dice metric | 0.9103 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351653
Similarity: 0.7671
Similarity to MM351653
| Tanimoto metric | 0.7671 |
|---|---|
| Cosine metric | 0.8703 |
| Dice metric | 0.8682 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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