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DocumentationIdentifier: MM405876
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM405876 |
| SMILES |
CCN(CC)CC=CCF
|
| InChIKey |
YAHRDZAJRXPMKF-UHFFFAOYSA-N
|
| MW [Da] |
145.22
Automatically obtained from RDkit software. |
| LogP |
1.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM66615
Similarity: 0.7436
Similarity to MM66615
| Tanimoto metric | 0.7436 |
|---|---|
| Cosine metric | 0.8563 |
| Dice metric | 0.8529 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199486
Similarity: 0.7419
Similarity to MM199486
| Tanimoto metric | 0.7419 |
|---|---|
| Cosine metric | 0.8614 |
| Dice metric | 0.8519 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279771
Similarity: 0.725
Similarity to MM279771
| Tanimoto metric | 0.725 |
|---|---|
| Cosine metric | 0.8449 |
| Dice metric | 0.8406 |
| MW: | 145.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+465 more
