COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL131713
Chemical Name: 5-(8-methoxy-4-oxo-2-thioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(2-sulfanylethyl)pentanamide
Smiles: SCCNC(=O)CCCCn1c(=S)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

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Molecular Weight: 406.53
Empirical Formula: C18H22N4O3S2

Available Amount: 0 mg

Lipinsky:
logP: 1.031
Rotatable bonds: 9
H-donors: 3
H-acceptors: 3
PSA: 157
Number of rings: 3

     

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