Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM254969
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254969 |
| SMILES |
C=C(CCC(=N)N)C(C)C
|
| InChIKey |
AAPFOVZKERDGBG-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144801
Similarity: 0.8021
Similarity to MM144801
| Tanimoto metric | 0.8021 |
|---|---|
| Cosine metric | 0.8956 |
| Dice metric | 0.8902 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM251034
Similarity: 0.7573
Similarity to MM251034
| Tanimoto metric | 0.7573 |
|---|---|
| Cosine metric | 0.8635 |
| Dice metric | 0.8619 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM251035
Similarity: 0.7264
Similarity to MM251035
| Tanimoto metric | 0.7264 |
|---|---|
| Cosine metric | 0.8425 |
| Dice metric | 0.8415 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+231 more
