COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK835048
Chemical Name: (4E)-4-(4-chlorobenzylidene)-5-(morpholin-4-yl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])N1CCOCC1

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Molecular Weight: 412.83
Empirical Formula: C20H17ClN4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.574
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 90
Number of rings: 4

     

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