COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK441216
Chemical Name: 5,5'-butane-1,4-diylbis[4-(5-chloro-2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol]
Smiles: COc1ccc(cc1n1c(CCCCc2nnc(n2c2cc(Cl)ccc2OC)S)nnc1S)Cl

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Molecular Weight: 537.49
Empirical Formula: C22H22Cl2N6O2S2

Physical State: Dry powder
Available Amount: 588 mg

Lipinsky:
logP: 7.296
Rotatable bonds: 9
H-donors: 0
H-acceptors: 2
PSA: 157
Number of rings: 4

     

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