Identifier: MM179613
2D Structure
3D Structure
Source:
General | |
Identifier | MM179613 |
SMILES |
CCNC(CC)C(C)C
|
InChIKey |
VVENKBZYPINLSL-UHFFFAOYSA-N
|
MW [Da] |
129.25
Automatically obtained from RDkit software. |
LogP |
2.03
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM306659
Similarity: 0.9394
Similarity to MM306659
Tanimoto metric | 0.9394 |
---|---|
Cosine metric | 0.9692 |
Dice metric | 0.9688 |
MW: | 143.27 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.28 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM392274
Similarity: 0.8158
Similarity to MM392274
Tanimoto metric | 0.8158 |
---|---|
Cosine metric | 0.9032 |
Dice metric | 0.8986 |
MW: | 144.26 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.97 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM392419
Similarity: 0.7949
Similarity to MM392419
Tanimoto metric | 0.7949 |
---|---|
Cosine metric | 0.8916 |
Dice metric | 0.8857 |
MW: | 141.26 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.2 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+686 more