Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM377205
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM377205 |
| SMILES |
C#CC(CC#N)C(C)C#N
|
| InChIKey |
WGBSZDGMGKYPLB-UHFFFAOYSA-N
|
| MW [Da] |
132.17
Automatically obtained from RDkit software. |
| LogP |
1.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM376983
Similarity: 0.7742
Similarity to MM376983
| Tanimoto metric | 0.7742 |
|---|---|
| Cosine metric | 0.874 |
| Dice metric | 0.8727 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377167
Similarity: 0.6863
Similarity to MM377167
| Tanimoto metric | 0.6863 |
|---|---|
| Cosine metric | 0.8175 |
| Dice metric | 0.814 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM178101
Similarity: 0.6667
Similarity to MM178101
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 118.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+273 more
