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DocumentationIdentifier: MM353583
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM353583 |
| SMILES |
C=C(CC)CCC(C)CO
|
| InChIKey |
YSDHYUIFZIGMRL-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM353310
Similarity: 0.8442
Similarity to MM353310
| Tanimoto metric | 0.8442 |
|---|---|
| Cosine metric | 0.9188 |
| Dice metric | 0.9155 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340381
Similarity: 0.7647
Similarity to MM340381
| Tanimoto metric | 0.7647 |
|---|---|
| Cosine metric | 0.867 |
| Dice metric | 0.8667 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM367918
Similarity: 0.7204
Similarity to MM367918
| Tanimoto metric | 0.7204 |
|---|---|
| Cosine metric | 0.8381 |
| Dice metric | 0.8375 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+399 more
