COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK354728
Chemical Name: 4,7,7-trimethyl-3-{[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}bicyclo[2.2.1]heptan-2-one
Smiles: O=C1C(Sc2nc(cc(n2)C(F)(F)F)c2cccs2)C2(C(C1CC2)(C)C)C

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Molecular Weight: 412.5
Empirical Formula: C19H19F3N2OS2

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 5.573
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 96
Number of rings: 4

     

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