COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK530397
Chemical Name: 4,4',4'',4''',4'''',4'''''-[benzene-1,2,3,4,5,6-hexaylhexakis(carbonylimino)]hexabenzenesulfonicacid
Smiles: O=C(c1c(C(=O)Nc2ccc(cc2)S(=O)(=O)O)c(C(=O)Nc2ccc(cc2)S(=O)(=O)O)c(c(c1C(=O)Nc1ccc(cc1)S(=O)(=O)O)C(=O)Nc1ccc(cc1)S(=O)(=O)O)C(=O)Nc1ccc(cc1)S(=O)(=O)O)Nc1ccc(cc1)S(=O)(=O)O

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Molecular Weight: 1273.24
Empirical Formula: C48H36N6O24S6

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: -1.233
Rotatable bonds: 6
H-donors: 12
H-acceptors: 24
PSA: 551
Number of rings: 7

     

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