Identifier: MM288270
2D Structure
3D Structure
Source:
General | |
Identifier | MM288270 |
SMILES |
CC(C)NCC#CCC#N
|
InChIKey |
WBBIPTRQSOVBTL-UHFFFAOYSA-N
|
MW [Da] |
136.2
Automatically obtained from RDkit software. |
LogP |
0.9
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM215955
Similarity: 0.8594
Similarity to MM215955
Tanimoto metric | 0.8594 |
---|---|
Cosine metric | 0.927 |
Dice metric | 0.9244 |
MW: | 122.17 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.51 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM153419
Similarity: 0.7969
Similarity to MM153419
Tanimoto metric | 0.7969 |
---|---|
Cosine metric | 0.8927 |
Dice metric | 0.887 |
MW: | 125.22 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.4 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM459456
Similarity: 0.7805
Similarity to MM459456
Tanimoto metric | 0.7805 |
---|---|
Cosine metric | 0.8835 |
Dice metric | 0.8767 |
MW: | 134.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.66 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+590 more