COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK978325
Chemical Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(quinolin-8-ylsulfanyl)ethanone
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CSc1cccc2c1nccc2

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Molecular Weight: 421.52
Empirical Formula: C23H23N3O3S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 3.071
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 5

     

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