Chelist Moleculee
cas:32598-13-3
einecs:
smiles:Clc1ccc(cc1Cl)-c2ccc(Cl)c(Cl)c2
name:1,1'-Biphenyl, 3,3',4,4'-Tetrachloro-
MW:291.988
formula:C12H6Cl4
InChi:
InChiKey:
SMARTS:

Search by similarity
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

DGENV EAS (585): DG ENV EDS Database (EU Research Projects)
JRC METABOLISM BIOACCUMULATION (94): JRC ADME - Human bioaccumulation potential and human and rat metabolic stability and metabolite identification (JRC Projects)