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DocumentationRhodamine 110
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM01361 |
| SMILES |
Nc1ccc2c(-c3ccccc3C(=O)O)c3ccc(=[NH2+])cc-3oc2c1
|
| InChIKey |
UPZKDDJKJWYWHQ-UHFFFAOYSA-O
|
| MW [Da] |
331.35
Automatically obtained from RDkit software. |
| LogP |
2.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
Rhodamine 116
Similarity: 0.9441
Similarity to Rhodamine 116
| Tanimoto metric | 0.9441 |
|---|---|
| Cosine metric | 0.9716 |
| Dice metric | 0.9712 |
| MW: | 359.41 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
Rhodamine B
Similarity: 0.8811
Similarity to Rhodamine B
| Tanimoto metric | 0.8811 |
|---|---|
| Cosine metric | 0.9387 |
| Dice metric | 0.9368 |
| MW: | 443.57 |
||||
|---|---|---|---|---|---|
| PI: | 7
Total passive interactions
|
| LogP: | 5.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
Tetramethylrosamine
Similarity: 0.75
Similarity to Tetramethylrosamine
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8583 |
| Dice metric | 0.8571 |
| MW: | 343.45 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 4.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
