COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL477688
Chemical Name: 2-(2-{[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCSc2nnc3c(n2)n(CCc2ccccc2)c2c3cccc2)C(=O)c2c1cccc2

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Molecular Weight: 479.56
Empirical Formula: C27H21N5O2S

Physical State: Dry powder
Available Amount: 187 mg

Lipinsky:
logP: 6.007
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 106
Number of rings: 6

     

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