Basic Red 1 (Predicted)
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Basic Info
FADB-China ID | P0155 |
Molecular Name | Basic Red 1 |
Basis for prediction | Rhodamine B |
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint) | 0.5085 |
Similarity (based on Tanimoto coefficient and Daylight fingerprint) | 0.8516 |
Similarity (based on MCS) | 0.0526 |
2D Structure | |
SMILES | CCNc1cc2oc3cc(=[NH+]CC)c(C)cc-3c(-c3ccccc3C(=O)OCC)c2cc1C.[Cl-] |
CFM-ID 3.0 (Copy SMILES to the website's input box) | URL Link |
Update Date | Jul 30, 2019 14:16 |
References
Title | Data Sources |
---|---|
Source | HPV EPA Chemicals, T3DB, ToxCast & Tox21 Chemicals, IARC Carcinogens Group 3 |
PubChem Link | URL Link |