COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565720
Chemical Name: 2-bromo-4-{(Z)-[2-({4-[(4-bromophenyl)sulfonyl]piperazin-1-ium-1-yl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Smiles: COc1cc(/C=N\NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)c2ccc(cc2)Br)cc(c1[O-])Br

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Molecular Weight: 590.29
Empirical Formula: C20H22Br2N4O5S

Physical State: Dry powder
Available Amount: 275 mg

Lipinsky:
logP: 5.802
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 123
Number of rings: 3

     

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