COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192370
Chemical Name: 2-[(4-{(E)-[1-(2,3-dichlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)methyl]benzonitrile
Smiles: N#Cc1ccccc1COc1ccc(cc1)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl

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Molecular Weight: 508.38
Empirical Formula: C25H15Cl2N3O3S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 5.358
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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