COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045189
Chemical Name: 1-(4-fluorophenyl)-4-hydroxy-7-(thiophen-2-yl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
Smiles: Fc1ccc(cc1)n1c(=O)nc(c2c1NC(=NC2(C(F)(F)F)C(F)(F)F)c1cccs1)O

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Molecular Weight: 478.35
Empirical Formula: C18H9F7N4O2S

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 6.351
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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