COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675045
Chemical Name: dimethyl5-({[4-chloro-3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]sulfonyl}amino)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NS(=O)(=O)c1ccc(c(c1)N1C(=O)C2C(C1=O)C1CC2C=C1)Cl

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Molecular Weight: 544.97
Empirical Formula: C25H21ClN2O8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.107
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 144
Number of rings: 5

     

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