COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734037
Chemical Name: 2-({2-[4-(4-nitrophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-3-phenylquinazolin-4(3H)-one
Smiles: O=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])CSc1nc2ccccc2c(=O)n1c1ccccc1

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Molecular Weight: 501.57
Empirical Formula: C26H23N5O4S

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 4.562
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 127
Number of rings: 5

     

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