COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562515
Chemical Name: N-{(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}isoleucine
Smiles: CCC(C(C(=O)O)N/C=C/1\C(=O)N=C(N(C1=O)c1ccc(cc1)F)S)C

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Molecular Weight: 379.41
Empirical Formula: C17H18FN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.041
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 137
Number of rings: 2

     

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