Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM370179
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370179 |
| SMILES |
CCC#CCCC(N)CC
|
| InChIKey |
IVAGZBIUZQJOKD-UHFFFAOYSA-N
|
| MW [Da] |
139.24
Automatically obtained from RDkit software. |
| LogP |
1.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167643
Similarity: 0.9677
Similarity to MM167643
| Tanimoto metric | 0.9677 |
|---|---|
| Cosine metric | 0.9837 |
| Dice metric | 0.9836 |
| MW: | 125.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370181
Similarity: 0.8857
Similarity to MM370181
| Tanimoto metric | 0.8857 |
|---|---|
| Cosine metric | 0.9411 |
| Dice metric | 0.9394 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM278987
Similarity: 0.8571
Similarity to MM278987
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9241 |
| Dice metric | 0.9231 |
| MW: | 135.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+567 more
