COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328992
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1c(OC)cc(cc1OC)c1nnc(n1c1ccc2c(c1)OCCO2)S

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Molecular Weight: 401.44
Empirical Formula: C19H19N3O5S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 4.786
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 115
Number of rings: 4

     

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