COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK774354
Chemical Name: 4-(4-chlorophenyl)-7,7-dimethyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)Cl

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Molecular Weight: 460.02
Empirical Formula: C22H22ClN3O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.533
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 4

     

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