COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK161386
Chemical Name: 2-{3-chloro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}-1H-indene-1,3(2H)-dione
Smiles: Clc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F)/C=C/1\C(=O)c2c(C1=O)cccc2

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Molecular Weight: 473.79
Empirical Formula: C23H11ClF3NO5

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.044
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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