COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK023044
Chemical Name: 4-chloro-N-{[4-(5-nitroquinolin-8-yl)piperazin-1-yl]carbonothioyl}benzamide
Smiles: Clc1ccc(cc1)C(=O)NC(=S)N1CCN(CC1)c1ccc(c2c1nccc2)[N+](=O)[O-]

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Molecular Weight: 455.92
Empirical Formula: C21H18ClN5O3S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 3.655
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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