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DocumentationIdentifier: MM307001
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307001 |
| SMILES |
C=C(C)C(CNC)C(=N)N
|
| InChIKey |
FUWRGIBJWXFYOD-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM181073
Similarity: 0.7415
Similarity to MM181073
| Tanimoto metric | 0.7415 |
|---|---|
| Cosine metric | 0.8611 |
| Dice metric | 0.8516 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM179954
Similarity: 0.6395
Similarity to MM179954
| Tanimoto metric | 0.6395 |
|---|---|
| Cosine metric | 0.7997 |
| Dice metric | 0.7801 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389431
Similarity: 0.618
Similarity to MM389431
| Tanimoto metric | 0.618 |
|---|---|
| Cosine metric | 0.7641 |
| Dice metric | 0.7639 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+50 more
