COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK800241
Chemical Name: 4-{[2-(3-bromophenyl)-4-hydroxy-1-(2-methoxyethyl)-5-oxo-2,5-dihydro-1H-pyrrol-3-yl]carbonyl}-N,N-dimethylbenzenesulfonamide
Smiles: COCCN1C(c2cccc(c2)Br)C(=C(C1=O)O)C(=O)c1ccc(cc1)S(=O)(=O)N(C)C

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Molecular Weight: 523.4
Empirical Formula: C22H23BrN2O6S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 3.164
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 112
Number of rings: 3

     

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