COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK394220
Chemical Name: (5Z)-1-(4-chlorophenyl)-5-({[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2c(C)nn(c2C)c2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 480.87
Empirical Formula: C22H17ClN6O5

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 3.539
Rotatable bonds: 0
H-donors: 2
H-acceptors: 5
PSA: 142
Number of rings: 4

     

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