COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150005
Chemical Name: (4Z)-4-{1-[(4,6-dimethoxypyrimidin-2-yl)amino]ethylidene}-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(OC)nc(n1)N/C(=C\1/C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C)/C

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Molecular Weight: 398.38
Empirical Formula: C18H18N6O5

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 0.726
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 134
Number of rings: 3

     

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