COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456739
Chemical Name: 1-(1,3-benzodioxol-5-yl)-3-{2-[(4-chlorophenyl)sulfanyl]phenyl}thiourea
Smiles: S=C(Nc1ccccc1Sc1ccc(cc1)Cl)Nc1ccc2c(c1)OCO2

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Molecular Weight: 414.94
Empirical Formula: C20H15ClN2O2S2

Physical State: Dry powder
Available Amount: 28 mg

Lipinsky:
logP: 5.391
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 99
Number of rings: 4

     

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