Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM80966
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM80966 |
| SMILES |
C#CC(=N)N(C)C(=C)C
|
| InChIKey |
TVZQUKBTSDPJDR-UHFFFAOYSA-N
|
| MW [Da] |
122.17
Automatically obtained from RDkit software. |
| LogP |
1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM59151
Similarity: 0.8151
Similarity to MM59151
| Tanimoto metric | 0.8151 |
|---|---|
| Cosine metric | 0.9028 |
| Dice metric | 0.8981 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM353483
Similarity: 0.7438
Similarity to MM353483
| Tanimoto metric | 0.7438 |
|---|---|
| Cosine metric | 0.8624 |
| Dice metric | 0.853 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307190
Similarity: 0.6939
Similarity to MM307190
| Tanimoto metric | 0.6939 |
|---|---|
| Cosine metric | 0.8201 |
| Dice metric | 0.8193 |
| MW: | 136.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+260 more
