Identifier: MM138224
2D Structure
3D Structure
Source:
General | |
Identifier | MM138224 |
SMILES |
CCC(C)(N)CNC=N
|
InChIKey |
KHBJRBPGCDWZJO-UHFFFAOYSA-N
|
MW [Da] |
129.21
Automatically obtained from RDkit software. |
LogP |
0.31
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM233805
Similarity: 0.783
Similarity to MM233805
Tanimoto metric | 0.783 |
---|---|
Cosine metric | 0.8849 |
Dice metric | 0.8783 |
MW: | 144.22 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.75 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM102756
Similarity: 0.6506
Similarity to MM102756
Tanimoto metric | 0.6506 |
---|---|
Cosine metric | 0.8066 |
Dice metric | 0.7883 |
MW: | 115.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.08 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM308001
Similarity: 0.6385
Similarity to MM308001
Tanimoto metric | 0.6385 |
---|---|
Cosine metric | 0.799 |
Dice metric | 0.7793 |
MW: | 145.21 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.72 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+446 more