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DocumentationIdentifier: MM74875
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM74875 |
| SMILES |
CCNCC(C)NCCF
|
| InChIKey |
VBICCTBGBMTXSW-UHFFFAOYSA-N
|
| MW [Da] |
148.23
Automatically obtained from RDkit software. |
| LogP |
0.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM155700
Similarity: 0.913
Similarity to MM155700
| Tanimoto metric | 0.913 |
|---|---|
| Cosine metric | 0.9555 |
| Dice metric | 0.9545 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM165570
Similarity: 0.8082
Similarity to MM165570
| Tanimoto metric | 0.8082 |
|---|---|
| Cosine metric | 0.8949 |
| Dice metric | 0.8939 |
| MW: | 134.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250512
Similarity: 0.759
Similarity to MM250512
| Tanimoto metric | 0.759 |
|---|---|
| Cosine metric | 0.8643 |
| Dice metric | 0.863 |
| MW: | 152.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+281 more
