COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683718
Chemical Name: 4-(4-fluorophenyl)-7,7-dimethyl-1-(5-{[3-(trifluoromethyl)benzyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CC(C2)(C)C)c1nnc(s1)SCc1cccc(c1)C(F)(F)F

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Molecular Weight: 561.62
Empirical Formula: C27H23F4N3O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.511
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 5

     

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