COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675427
Chemical Name: 5-amino-3-{(Z)-1-cyano-2-[4-(4-methylpiperazin-1-yl)-3-nitrophenyl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Smiles: OCCn1nc(c(c1N)C#N)/C(=C/c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C)/C#N

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Molecular Weight: 422.45
Empirical Formula: C20H22N8O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.228
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 163
Number of rings: 3

     

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