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DocumentationIdentifier: MM301681
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM301681 |
| SMILES |
C=C(C)C(N)CCNC=N
|
| InChIKey |
SRDADYSWNBXIJM-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM92152
Similarity: 0.81
Similarity to MM92152
| Tanimoto metric | 0.81 |
|---|---|
| Cosine metric | 0.9 |
| Dice metric | 0.895 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM93929
Similarity: 0.7105
Similarity to MM93929
| Tanimoto metric | 0.7105 |
|---|---|
| Cosine metric | 0.831 |
| Dice metric | 0.8308 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM166076
Similarity: 0.71
Similarity to MM166076
| Tanimoto metric | 0.71 |
|---|---|
| Cosine metric | 0.8426 |
| Dice metric | 0.8304 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+411 more
