COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK587349
Chemical Name: N-benzyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline-8(7H)-carbothioamide
Smiles: S=C(N1CCc2c(C1)cc1c(c2)OCCCO1)NCc1ccccc1

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Molecular Weight: 354.47
Empirical Formula: C20H22N2O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.536
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 65
Number of rings: 4

     

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