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DocumentationIdentifier: MM447775
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447775 |
| SMILES |
C=CCNCCNC=NC
|
| InChIKey |
CLVWGWXJGJKOIQ-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.01
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM213105
Similarity: 0.8305
Similarity to MM213105
| Tanimoto metric | 0.8305 |
|---|---|
| Cosine metric | 0.9113 |
| Dice metric | 0.9074 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM287227
Similarity: 0.6712
Similarity to MM287227
| Tanimoto metric | 0.6712 |
|---|---|
| Cosine metric | 0.8037 |
| Dice metric | 0.8033 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM447566
Similarity: 0.6301
Similarity to MM447566
| Tanimoto metric | 0.6301 |
|---|---|
| Cosine metric | 0.7731 |
| Dice metric | 0.7731 |
| MW: | 147.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+250 more
