Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM330975
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM330975 |
| SMILES |
CCC(CC)N=C(C)NC
|
| InChIKey |
VDFHXCILUMIXQQ-UHFFFAOYSA-N
|
| MW [Da] |
142.25
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
MM142931
Similarity: 0.898
Similarity to MM142931
| Tanimoto metric | 0.898 |
|---|---|
| Cosine metric | 0.9476 |
| Dice metric | 0.9462 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM247824
Similarity: 0.7521
Similarity to MM247824
| Tanimoto metric | 0.7521 |
|---|---|
| Cosine metric | 0.8594 |
| Dice metric | 0.8585 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227291
Similarity: 0.7333
Similarity to MM227291
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8476 |
| Dice metric | 0.8462 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+166 more
