COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705882
Chemical Name: 4-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-nitro-N-[4-(propan-2-yl)benzyl]benzamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)C(C)C)c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 450.94
Empirical Formula: C21H23ClN2O5S

Physical State: Dry powder
Available Amount: 394 mg

Lipinsky:
logP: 2.973
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 108
Number of rings: 3

     

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