COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK423106
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](3,4-dichloro-1-benzothiophen-2-yl)methanone
Smiles: O=C(c1sc2c(c1Cl)c(Cl)ccc2)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 449.36
Empirical Formula: C21H18Cl2N2O3S

Physical State: Dry powder
Available Amount: 1975 mg

Lipinsky:
logP: 5.058
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 70
Number of rings: 5

     

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