COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK368125
Chemical Name: 2,2'-(E)-ethene-1,2-diylbis(5-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]amino}benzenesulfonate)
Smiles: [O-]S(=O)(=O)c1cc(ccc1/C=C/c1ccc(cc1S(=O)(=O)[O-])Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1)Nc1nc(Nc2ccccc2)nc(n1)N1CCOCC1

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Saltdata: 2Na+
Molecular Weight: 878.95
Empirical Formula: C40H38N12O8S2

Physical State: Dry powder
Available Amount: 11 mg

Lipinsky:
logP: -1.327
Rotatable bonds: 2
H-donors: 4
H-acceptors: 8
PSA: 281
Number of rings: 8

     

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