Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM272876
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272876 |
| SMILES |
CC#CC(C#N)CC(C)C
|
| InChIKey |
CZUCLUYWUATEBK-UHFFFAOYSA-N
|
| MW [Da] |
135.21
Automatically obtained from RDkit software. |
| LogP |
2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM389464
Similarity: 0.8191
Similarity to MM389464
| Tanimoto metric | 0.8191 |
|---|---|
| Cosine metric | 0.9006 |
| Dice metric | 0.9006 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389438
Similarity: 0.8085
Similarity to MM389438
| Tanimoto metric | 0.8085 |
|---|---|
| Cosine metric | 0.8941 |
| Dice metric | 0.8941 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM379924
Similarity: 0.7957
Similarity to MM379924
| Tanimoto metric | 0.7957 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.8862 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+436 more
