COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK125091
Chemical Name: diethyl3-methyl-5-({[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}methyl)-1H-pyrrole-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(CSc2nnc3c(n2)n(CC=C)c2c3cccc2)[nH]c(c1C)C(=O)OCC

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Molecular Weight: 479.56
Empirical Formula: C24H25N5O4S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 5.946
Rotatable bonds: 11
H-donors: 1
H-acceptors: 4
PSA: 137
Number of rings: 4

     

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