COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048782
Chemical Name: (5E)-5-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methylidene)-1-(4-fluorobenzyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)CN1C(=NC(=O)/C(=C\NCCC2=CCCCC2)/C1=O)S

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Molecular Weight: 387.48
Empirical Formula: C20H22FN3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.307
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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