COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK542592
Chemical Name: 3,3'-(butane-1,4-diyldisulfanediyl)bis[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole]
Smiles: COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCCCCSc1nnc(n1c1ccccc1)c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 740.9
Empirical Formula: C38H40N6O6S2

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 11.098
Rotatable bonds: 11
H-donors: 0
H-acceptors: 6
PSA: 167
Number of rings: 6

     

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