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DocumentationIdentifier: MM181073
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM181073 |
| SMILES |
C=C(C)C(CN)C(=N)N
|
| InChIKey |
JGZLKTNITCBVFM-UHFFFAOYSA-N
|
| MW [Da] |
127.19
Automatically obtained from RDkit software. |
| LogP |
0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM389431
Similarity: 0.773
Similarity to MM389431
| Tanimoto metric | 0.773 |
|---|---|
| Cosine metric | 0.8792 |
| Dice metric | 0.872 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389637
Similarity: 0.7517
Similarity to MM389637
| Tanimoto metric | 0.7517 |
|---|---|
| Cosine metric | 0.867 |
| Dice metric | 0.8583 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM307001
Similarity: 0.7415
Similarity to MM307001
| Tanimoto metric | 0.7415 |
|---|---|
| Cosine metric | 0.8611 |
| Dice metric | 0.8516 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+308 more
