COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK210880
Chemical Name: 4-(2-chloro-5-nitrophenyl)-8-methyl-2-[(4-methylphenyl)amino]-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Smiles: Cc1ccc(cc1)NC1=NC(n2c(N1)nc(C)cc2=O)c1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 424.85
Empirical Formula: C20H17ClN6O3

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 3.389
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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