Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM137737
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM137737 |
| SMILES |
C#CC(C)(C)C(C)C#N
|
| InChIKey |
YRNNTRUQHGKAAO-UHFFFAOYSA-N
|
| MW [Da] |
121.18
Automatically obtained from RDkit software. |
| LogP |
1.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM228889
Similarity: 0.85
Similarity to MM228889
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.922 |
| Dice metric | 0.9189 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM137687
Similarity: 0.7436
Similarity to MM137687
| Tanimoto metric | 0.7436 |
|---|---|
| Cosine metric | 0.8529 |
| Dice metric | 0.8529 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111661
Similarity: 0.7353
Similarity to MM111661
| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8475 |
| MW: | 107.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+460 more
