COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK024928
Chemical Name: 2-({3-[(E)-(1-methyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1H-indol-1-yl}methyl)benzonitrile
Smiles: N#Cc1ccccc1Cn1cc(c2c1cccc2)/C=C/1\C(=O)NC(=S)N(C1=O)C

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Molecular Weight: 400.46
Empirical Formula: C22H16N4O2S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 2.969
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 110
Number of rings: 4

     

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