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DocumentationIdentifier: MM348342
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348342 |
| SMILES |
C=CC(O)C(N)C(N)CC
|
| InChIKey |
VAXYQHHPGWRZAD-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160021
Similarity: 0.8296
Similarity to MM160021
| Tanimoto metric | 0.8296 |
|---|---|
| Cosine metric | 0.9108 |
| Dice metric | 0.9069 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172066
Similarity: 0.7037
Similarity to MM172066
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8389 |
| Dice metric | 0.8261 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362403
Similarity: 0.651
Similarity to MM362403
| Tanimoto metric | 0.651 |
|---|---|
| Cosine metric | 0.7924 |
| Dice metric | 0.7886 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+295 more
