COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048501
Chemical Name: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-sulfanyl-5-({[3-(trifluoromethyl)phenyl]amino}methylidene)pyrimidine-4,6(1H,5H)-dione
Smiles: SC1=NC(=O)/C(=C\Nc2cccc(c2)C(F)(F)F)/C(=O)N1CCC1=CCCCC1

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Molecular Weight: 423.46
Empirical Formula: C20H20F3N3O2S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 5.123
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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