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DocumentationIdentifier: MM370403
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370403 |
| SMILES |
C#CC#CCOC(C)CF
|
| InChIKey |
YAMFHGYCLIXJQP-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167660
Similarity: 0.8667
Similarity to MM167660
| Tanimoto metric | 0.8667 |
|---|---|
| Cosine metric | 0.9309 |
| Dice metric | 0.9286 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370258
Similarity: 0.7927
Similarity to MM370258
| Tanimoto metric | 0.7927 |
|---|---|
| Cosine metric | 0.8845 |
| Dice metric | 0.8844 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370353
Similarity: 0.7386
Similarity to MM370353
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8498 |
| Dice metric | 0.8497 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+454 more
