Identifier: MM112657
2D Structure
3D Structure
Source:
General | |
Identifier | MM112657 |
SMILES |
N=CNCC(N)CO
|
InChIKey |
ZWTGQCUQGVCRIO-UHFFFAOYSA-N
|
MW [Da] |
117.15
Automatically obtained from RDkit software. |
LogP |
-1.5
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM167154
Similarity: 0.8108
Similarity to MM167154
Tanimoto metric | 0.8108 |
---|---|
Cosine metric | 0.9005 |
Dice metric | 0.8955 |
MW: | 131.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -1.45 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM155763
Similarity: 0.7595
Similarity to MM155763
Tanimoto metric | 0.7595 |
---|---|
Cosine metric | 0.8715 |
Dice metric | 0.8633 |
MW: | 131.18 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | -0.84 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM198661
Similarity: 0.7595
Similarity to MM198661
Tanimoto metric | 0.7595 |
---|---|
Cosine metric | 0.8715 |
Dice metric | 0.8633 |
MW: | 131.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -1.24 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+402 more