Identifier: MM53218
2D Structure
3D Structure
Source:
General | |
Identifier | MM53218 |
SMILES |
C=C(CC)NC(=O)CCN
|
InChIKey |
KXBDYSKVZSPKSW-UHFFFAOYSA-N
|
MW [Da] |
142.2
Automatically obtained from RDkit software. |
LogP |
0.38
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM142588
Similarity: 0.8246
Similarity to MM142588
Tanimoto metric | 0.8246 |
---|---|
Cosine metric | 0.9081 |
Dice metric | 0.9038 |
MW: | 127.19 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.44 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM135522
Similarity: 0.807
Similarity to MM135522
Tanimoto metric | 0.807 |
---|---|
Cosine metric | 0.8983 |
Dice metric | 0.8932 |
MW: | 128.18 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | -0.02 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM68742
Similarity: 0.736
Similarity to MM68742
Tanimoto metric | 0.736 |
---|---|
Cosine metric | 0.849 |
Dice metric | 0.8479 |
MW: | 142.2 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 0.25 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+579 more