COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL408566
Chemical Name: (5E)-3-(butan-2-yl)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxy-2-thioxo-2,5-dihydropyrimidin-4(3H)-one
Smiles: CCC(N1C(=S)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)O)C

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Molecular Weight: 453.99
Empirical Formula: C24H24ClN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.505
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 88
Number of rings: 4

     

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