COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705747
Chemical Name: 4-chloro-N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-nitrobenzamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)N(C)C)c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 451.93
Empirical Formula: C20H22ClN3O5S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.743
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 3

     

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