COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054464
Chemical Name: 3-[(3,4-dichlorobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazole
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCc1ccc(c(c1)Cl)Cl

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Molecular Weight: 446.36
Empirical Formula: C21H17Cl2N3O2S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 6.809
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 78
Number of rings: 4

     

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