COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL072049
Chemical Name: dimethyl2-[({4-[(methylsulfonyl)(prop-2-en-1-yl)amino]phenyl}carbonyl)amino]benzene-1,4-dicarboxylate
Smiles: C=CCN(S(=O)(=O)C)c1ccc(cc1)C(=O)Nc1cc(ccc1C(=O)OC)C(=O)OC

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Molecular Weight: 446.48
Empirical Formula: C21H22N2O7S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 4.283
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 127
Number of rings: 2

     

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