COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK315098
Chemical Name: 2-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-4-nitro-1H-isoindole-1,3(2H)-dione
Smiles: Clc1cccc(c1Cn1nc(c(c1C)N1C(=O)c2c(C1=O)cccc2[N+](=O)[O-])C)Cl

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Molecular Weight: 445.26
Empirical Formula: C20H14Cl2N4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.814
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 101
Number of rings: 4

     

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