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DocumentationIdentifier: MM91296
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM91296 |
| SMILES |
CC=CNC=NCCNC
|
| InChIKey |
GQZPEUHVLIRGFX-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM214857
Similarity: 0.8308
Similarity to MM214857
| Tanimoto metric | 0.8308 |
|---|---|
| Cosine metric | 0.9115 |
| Dice metric | 0.9076 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM451380
Similarity: 0.7639
Similarity to MM451380
| Tanimoto metric | 0.7639 |
|---|---|
| Cosine metric | 0.8664 |
| Dice metric | 0.8661 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM452944
Similarity: 0.76
Similarity to MM452944
| Tanimoto metric | 0.76 |
|---|---|
| Cosine metric | 0.8637 |
| Dice metric | 0.8636 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+334 more
