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DocumentationIdentifier: MM284824
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM284824 |
| SMILES |
CC(=CCNC=N)NC=N
|
| InChIKey |
RLTKYVIAJRTFCD-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107883
Similarity: 0.7778
Similarity to MM107883
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8819 |
| Dice metric | 0.875 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM284825
Similarity: 0.6893
Similarity to MM284825
| Tanimoto metric | 0.6893 |
|---|---|
| Cosine metric | 0.818 |
| Dice metric | 0.8161 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM360272
Similarity: 0.6696
Similarity to MM360272
| Tanimoto metric | 0.6696 |
|---|---|
| Cosine metric | 0.8094 |
| Dice metric | 0.8021 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+428 more
