COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438578
Chemical Name: 3-[1-(2,6-dichlorobenzyl)-1H-pyrazol-4-yl]-2-sulfanyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Clc1cccc(c1Cn1ncc(c1)n1c(S)nc2c(c1=O)c1CCCCCc1s2)Cl

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Molecular Weight: 477.44
Empirical Formula: C21H18Cl2N4OS2

Physical State: Dry powder
Available Amount: 710 mg

Lipinsky:
logP: 5.829
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 117
Number of rings: 5

     

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