COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK125632
Chemical Name: (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl{[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetate
Smiles: C=CCn1c2ccccc2c2c1nc(SCC(=O)OCN1C(=O)c3c(C1=O)cccc3)nn2

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Molecular Weight: 459.49
Empirical Formula: C23H17N5O4S

Physical State: Dry powder
Available Amount: 247 mg

Lipinsky:
logP: 4.35
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 5

     

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