COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435120
Chemical Name: [6-chloro-2-(5-methylthiophen-2-yl)quinolin-4-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Smiles: Clc1ccc2c(c1)c(cc(n2)c1ccc(s1)C)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 492.99
Empirical Formula: C25H21ClN4O3S

Physical State: Dry powder
Available Amount: 896 mg

Lipinsky:
logP: 4.91
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 110
Number of rings: 5

     

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