COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK470402
Chemical Name: (2E)-2-[(4-chlorophenyl)sulfonyl]-3-[1-(2,4-dichlorobenzyl)-1H-pyrrol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1cccn1Cc1ccc(cc1Cl)Cl)/S(=O)(=O)c1ccc(cc1)Cl

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Molecular Weight: 451.76
Empirical Formula: C20H13Cl3N2O2S

Physical State: Dry powder
Available Amount: 211 mg

Lipinsky:
logP: 5.548
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 71
Number of rings: 3

     

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