COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807059
Chemical Name: 2,2'-{butane-1,4-diylbis[(4-phenyl-4H-1,2,4-triazole-5,3-diyl)sulfanediyl]}bis(1-phenylethanone)
Smiles: O=C(c1ccccc1)CSc1nnc(n1c1ccccc1)CCCCc1nnc(n1c1ccccc1)SCC(=O)c1ccccc1

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Molecular Weight: 644.82
Empirical Formula: C36H32N6O2S2

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 9.295
Rotatable bonds: 11
H-donors: 0
H-acceptors: 2
PSA: 146
Number of rings: 6

     

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