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DocumentationIdentifier: MM325940
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325940 |
| SMILES |
CCC(C)NC(CC)CF
|
| InChIKey |
DJNSDJMFWLCVGO-UHFFFAOYSA-N
|
| MW [Da] |
147.24
Automatically obtained from RDkit software. |
| LogP |
2.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141588
Similarity: 0.84
Similarity to MM141588
| Tanimoto metric | 0.84 |
|---|---|
| Cosine metric | 0.9165 |
| Dice metric | 0.913 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402216
Similarity: 0.8214
Similarity to MM402216
| Tanimoto metric | 0.8214 |
|---|---|
| Cosine metric | 0.9021 |
| Dice metric | 0.902 |
| MW: | 151.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402213
Similarity: 0.8118
Similarity to MM402213
| Tanimoto metric | 0.8118 |
|---|---|
| Cosine metric | 0.8964 |
| Dice metric | 0.8961 |
| MW: | 147.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+682 more
