COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324008
Chemical Name: 5-acetyl-6-methyl-2-sulfanyl-4-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(S)NC(=C(C1c1cccc(c1)C(F)(F)F)C(=O)C)C

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Saltdata: cyClo-{NH(CH2)2O(CH2)2}
Molecular Weight: 338.35
Empirical Formula: C16H13F3N2OS

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 2.981
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 91
Number of rings: 2

     

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