COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK190037
Chemical Name: 2-[(4-{(Z)-[1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-iodophenoxy)methyl]benzonitrile
Smiles: N#Cc1ccccc1COc1ccc(cc1I)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)F

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Molecular Weight: 583.38
Empirical Formula: C25H15FIN3O3S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 5.489
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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