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DocumentationIdentifier: MM370419
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370419 |
| SMILES |
CN=CNCC=C(C)CN
|
| InChIKey |
ROJZSVBXBLLYMT-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171057
Similarity: 0.8514
Similarity to MM171057
| Tanimoto metric | 0.8514 |
|---|---|
| Cosine metric | 0.9227 |
| Dice metric | 0.9197 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM283711
Similarity: 0.7778
Similarity to MM283711
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8775 |
| Dice metric | 0.875 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM284672
Similarity: 0.7683
Similarity to MM284672
| Tanimoto metric | 0.7683 |
|---|---|
| Cosine metric | 0.8692 |
| Dice metric | 0.869 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+486 more
