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DocumentationIdentifier: MM258457
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM258457 |
| SMILES |
N=C(N)CCNC(=N)CN
|
| InChIKey |
GHFMPYYSIUFTNJ-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
-1.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166443
Similarity: 0.7556
Similarity to MM166443
| Tanimoto metric | 0.7556 |
|---|---|
| Cosine metric | 0.8692 |
| Dice metric | 0.8608 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364696
Similarity: 0.7083
Similarity to MM364696
| Tanimoto metric | 0.7083 |
|---|---|
| Cosine metric | 0.8332 |
| Dice metric | 0.8293 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM258456
Similarity: 0.6961
Similarity to MM258456
| Tanimoto metric | 0.6961 |
|---|---|
| Cosine metric | 0.8215 |
| Dice metric | 0.8208 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+128 more
