Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM396155
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM396155 |
| SMILES |
C#CC#CC(NC)C(C)C
|
| InChIKey |
BVXNQDDTSHTNFV-UHFFFAOYSA-N
|
| MW [Da] |
135.21
Automatically obtained from RDkit software. |
| LogP |
0.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180249
Similarity: 0.8155
Similarity to MM180249
| Tanimoto metric | 0.8155 |
|---|---|
| Cosine metric | 0.9031 |
| Dice metric | 0.8984 |
| MW: | 125.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM201221
Similarity: 0.7767
Similarity to MM201221
| Tanimoto metric | 0.7767 |
|---|---|
| Cosine metric | 0.8813 |
| Dice metric | 0.8743 |
| MW: | 121.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM433718
Similarity: 0.7257
Similarity to MM433718
| Tanimoto metric | 0.7257 |
|---|---|
| Cosine metric | 0.8424 |
| Dice metric | 0.841 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+507 more
