COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446231
Chemical Name: 1,4-bis[(2,4,5-trichlorophenyl)sulfonyl]-1,4-diazepane
Smiles: Clc1cc(Cl)c(cc1S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1cc(Cl)c(cc1Cl)Cl)Cl

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Molecular Weight: 587.16
Empirical Formula: C17H14Cl6N2O4S2

Physical State: Dry powder
Available Amount: 432 mg

Lipinsky:
logP: 7.116
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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