COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK868270
Chemical Name: (4E)-5-methyl-2-(4-nitrophenyl)-4-({[2-(4-propanoylpiperazin-1-yl)ethyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCC(=O)N1CCN(CC1)CCN/C=C/1\C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 414.46
Empirical Formula: C20H26N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.838
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 3

     

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