COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407908
Chemical Name: 3-{2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl}-6-nitroquinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)Cn1cnc2c(c1=O)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 442.86
Empirical Formula: C21H19ClN4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.933
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 4

     

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