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Chelist Moleculee
cas:76180-96-6
einecs:
smiles:Nc3nc2c(ccc1ncccc12)n3C
name:IQ (2-amino-3methylimidazo[4,5-f]quinoline)
MW:198.2239
formula:C11H10N4
InChi:
InChiKey:
SMARTS:
Other names
IQ
2-Amino-3-methylimidazo[4,5-f]quinoline (IQ - free base & HCL salt)

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Tanimoto index:
The algorithm applies nearest neighbor searching that finds molecules similar to the query object. The calculation applies the Tanimoto (or Jaccard) coefficient that is calculated by the following formula in the case of binary fingerprint (bit string) input: T(A,B) = NA&B/(NA+NB-NA&B) where NA and NB are the number of bits set in the bit strings of molecules A and B, respectively, NA&B is the number of bits that are set in both.

Inventory List where this chemical is present

TOX21 LIST1 (8205): Tox21 Chemical Inventory for High-Throughput Screening (International Research Projects)
In vitro genotoxicity (72): Updated recommended lists of genotoxic and non-genotoxic chemicals for assessment of the performance of new or improved genotoxicity tests (Method Validation)
ECVAMes_Positives List (723): ECVAM Ames Positives List: EURL ECVAM Genotoxicity and Carcinogenicity Database of Ames Positive Chemicals (JRC Projects)