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DocumentationIdentifier: MM377102
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM377102 |
| SMILES |
C#CC(NC=N)C(N)CN
|
| InChIKey |
SPQVVDMGRPXXKE-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
-1.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171962
Similarity: 0.6615
Similarity to MM171962
| Tanimoto metric | 0.6615 |
|---|---|
| Cosine metric | 0.8134 |
| Dice metric | 0.7963 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM74242
Similarity: 0.6149
Similarity to MM74242
| Tanimoto metric | 0.6149 |
|---|---|
| Cosine metric | 0.7615 |
| Dice metric | 0.7615 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377104
Similarity: 0.6048
Similarity to MM377104
| Tanimoto metric | 0.6048 |
|---|---|
| Cosine metric | 0.7541 |
| Dice metric | 0.7537 |
| MW: | 143.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+76 more
