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DocumentationIdentifier: MM376000
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376000 |
| SMILES |
CCC(OC=O)C(F)CN
|
| InChIKey |
ZMVOOHZYZIOOMT-UHFFFAOYSA-N
|
| MW [Da] |
149.17
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171996
Similarity: 0.7737
Similarity to MM171996
| Tanimoto metric | 0.7737 |
|---|---|
| Cosine metric | 0.8796 |
| Dice metric | 0.8724 |
| MW: | 135.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292680
Similarity: 0.6524
Similarity to MM292680
| Tanimoto metric | 0.6524 |
|---|---|
| Cosine metric | 0.7897 |
| Dice metric | 0.7897 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268534
Similarity: 0.6243
Similarity to MM268534
| Tanimoto metric | 0.6243 |
|---|---|
| Cosine metric | 0.7689 |
| Dice metric | 0.7687 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+86 more
