COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067939
Chemical Name: 2-(4H-1,2,4-triazol-3-ylsulfanyl)-1-[2,2,4-trimethyl-4-(3-methylphenyl)-3,4-dihydroquinolin-1(2H)-yl]ethanone
Smiles: Cc1cccc(c1)C1(C)CC(C)(C)N(c2c1cccc2)C(=O)CSc1nnc[nH]1

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Molecular Weight: 406.55
Empirical Formula: C23H26N4OS

Physical State: Dry powder
Available Amount: 891 mg

Lipinsky:
logP: 5.205
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 87
Number of rings: 4

     

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