Identifier: MM213300
2D Structure
3D Structure
Source:
General | |
Identifier | MM213300 |
SMILES |
CC=CCCCNC=N
|
InChIKey |
SWPYNAUDERERPU-UHFFFAOYSA-N
|
MW [Da] |
126.2
Automatically obtained from RDkit software. |
LogP |
1.54
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM125676
Similarity: 0.8393
Similarity to MM125676
Tanimoto metric | 0.8393 |
---|---|
Cosine metric | 0.9161 |
Dice metric | 0.9126 |
MW: | 112.18 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.15 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM448826
Similarity: 0.8116
Similarity to MM448826
Tanimoto metric | 0.8116 |
---|---|
Cosine metric | 0.9009 |
Dice metric | 0.896 |
MW: | 140.19 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.72 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM448984
Similarity: 0.8
Similarity to MM448984
Tanimoto metric | 0.8 |
---|---|
Cosine metric | 0.8944 |
Dice metric | 0.8889 |
MW: | 136.2 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.15 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+324 more