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DocumentationIdentifier: MM264417
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM264417 |
| SMILES |
C=C(C=CC)CC(=C)CC
|
| InChIKey |
WEPBTFPNORCTGZ-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 |
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MM135848
Similarity: 0.8095
Similarity to MM135848
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 122.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM264536
Similarity: 0.7556
Similarity to MM264536
| Tanimoto metric | 0.7556 |
|---|---|
| Cosine metric | 0.8625 |
| Dice metric | 0.8608 |
| MW: | 134.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM353873
Similarity: 0.7474
Similarity to MM353873
| Tanimoto metric | 0.7474 |
|---|---|
| Cosine metric | 0.8555 |
| Dice metric | 0.8554 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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