Identifier: MM214917
2D Structure
3D Structure
Source:
General | |
Identifier | MM214917 |
SMILES |
CCCC=CCNC=N
|
InChIKey |
XWSGDXUWHIPPAT-UHFFFAOYSA-N
|
MW [Da] |
126.2
Automatically obtained from RDkit software. |
LogP |
1.54
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
MM126142
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Similarity to MM126142
Tanimoto metric | 0.8393 |
---|---|
Cosine metric | 0.9161 |
Dice metric | 0.9126 |
MW: | 112.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.15 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM363226
Similarity: 0.7568
Similarity to MM363226
Tanimoto metric | 0.7568 |
---|---|
Cosine metric | 0.8699 |
Dice metric | 0.8615 |
MW: | 140.23 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.79 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM372778
Similarity: 0.7568
Similarity to MM372778
Tanimoto metric | 0.7568 |
---|---|
Cosine metric | 0.8699 |
Dice metric | 0.8615 |
MW: | 140.23 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.88 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+298 more