COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK447033
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl]thiourea
Smiles: S=C(Nc1ccc2c(c1)OCCO2)NCCCn1nc(cc1C)C

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Molecular Weight: 346.45
Empirical Formula: C17H22N4O2S

Physical State: Dry powder
Available Amount: 547 mg

Lipinsky:
logP: 2.328
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 92
Number of rings: 3

     

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