COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK450290
Chemical Name: 5-(1,3-benzodioxol-5-yl)-4-(3-methoxypropyl)-4H-1,2,4-triazole-3-thiol
Smiles: COCCCn1c(S)nnc1c1ccc2c(c1)OCO2

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Molecular Weight: 293.35
Empirical Formula: C13H15N3O3S

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 2.38
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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