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DocumentationIdentifier: MM316474
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM316474 |
| SMILES |
CCC(=N)NCC(C)CF
|
| InChIKey |
UNWFXNSOBHFLBN-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
1.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250885
Similarity: 0.8081
Similarity to MM250885
| Tanimoto metric | 0.8081 |
|---|---|
| Cosine metric | 0.8945 |
| Dice metric | 0.8939 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227972
Similarity: 0.7315
Similarity to MM227972
| Tanimoto metric | 0.7315 |
|---|---|
| Cosine metric | 0.8449 |
| Dice metric | 0.8449 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144631
Similarity: 0.7097
Similarity to MM144631
| Tanimoto metric | 0.7097 |
|---|---|
| Cosine metric | 0.8424 |
| Dice metric | 0.8302 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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