Chelist Moleculee

cas:	149877-41-8
einecs:	604-709-1
smiles:	COc1ccc(cc1NNC(=O)OC(C)C)c2ccccc2
name:	Hydrazinecarboxylic acid, 2-(4-methoxy[1,1'-biphenyl]-3-yl)-, 1-methylethyl ester
MW:	300.3523
formula:	C17H20N2O3
InChi:
InChiKey:
SMARTS:

Other names
bifenazate (ISO)
Bifenazate

Search by similarity

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) = N_A&B/(N_A+N_B-N_A&B) where N_A and N_B are the number of bits set in the bit strings of molecules A and B, respectively, N_A&B is the number of bits that are set in both.

Inventory List where this chemical is present

REACH PRS (143835): ECHA list of pre-registered substances (Regulatory)
TOXCAST PHASE I (320): US EPA ToxCast list - phase I (International Research Projects)
TOX21 LIST1 (8205): Tox21 Chemical Inventory for High-Throughput Screening (International Research Projects)
REACH REG (18846): Reach Registrations (Regulatory)