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DocumentationIdentifier: MM90586
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM90586 |
| SMILES |
C=C(NC=N)C(C)(F)F
|
| InChIKey |
CIMQBZVLHVFCBC-UHFFFAOYSA-N
|
| MW [Da] |
134.13
Automatically obtained from RDkit software. |
| LogP |
1.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM108416
Similarity: 0.7232
Similarity to MM108416
| Tanimoto metric | 0.7232 |
|---|---|
| Cosine metric | 0.8504 |
| Dice metric | 0.8394 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162943
Similarity: 0.6136
Similarity to MM162943
| Tanimoto metric | 0.6136 |
|---|---|
| Cosine metric | 0.7616 |
| Dice metric | 0.7606 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM91441
Similarity: 0.6071
Similarity to MM91441
| Tanimoto metric | 0.6071 |
|---|---|
| Cosine metric | 0.7792 |
| Dice metric | 0.7556 |
| MW: | 120.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+241 more
