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DocumentationIdentifier: MM373308
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM373308 |
| SMILES |
C=C(CN)NC=NCCN
|
| InChIKey |
KZBULZDGTCVNQK-UHFFFAOYSA-N
|
| MW [Da] |
142.21
Automatically obtained from RDkit software. |
| LogP |
-0.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM84006
Similarity: 0.8049
Similarity to MM84006
| Tanimoto metric | 0.8049 |
|---|---|
| Cosine metric | 0.8932 |
| Dice metric | 0.8919 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM85717
Similarity: 0.8022
Similarity to MM85717
| Tanimoto metric | 0.8022 |
|---|---|
| Cosine metric | 0.8913 |
| Dice metric | 0.8902 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM95056
Similarity: 0.7821
Similarity to MM95056
| Tanimoto metric | 0.7821 |
|---|---|
| Cosine metric | 0.8843 |
| Dice metric | 0.8777 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+352 more
