COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK762259
Chemical Name: (4Z)-2-(4-bromophenyl)-4-{[(5-chloro-2-methoxy-4-nitrophenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Br)C)Cl

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Molecular Weight: 465.69
Empirical Formula: C18H14BrClN4O4

Physical State: Dry powder
Available Amount: 413 mg

Lipinsky:
logP: 4.558
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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