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DocumentationIdentifier: MM292983
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292983 |
| SMILES |
C=CNC=NC(C)C(=C)C
|
| InChIKey |
GOSGQVCKPPEAGG-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM424838
Similarity: 0.7876
Similarity to MM424838
| Tanimoto metric | 0.7876 |
|---|---|
| Cosine metric | 0.8823 |
| Dice metric | 0.8812 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM255442
Similarity: 0.7647
Similarity to MM255442
| Tanimoto metric | 0.7647 |
|---|---|
| Cosine metric | 0.8667 |
| Dice metric | 0.8667 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199518
Similarity: 0.6637
Similarity to MM199518
| Tanimoto metric | 0.6637 |
|---|---|
| Cosine metric | 0.8045 |
| Dice metric | 0.7979 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+62 more
