COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK721394
Chemical Name: 8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SC/C=C(\Cl)/C)C

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Molecular Weight: 418.03
Empirical Formula: C21H24ClN3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.176
Rotatable bonds: 5
H-donors: 0
H-acceptors: 0
PSA: 92
Number of rings: 4

     

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