COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018715
Chemical Name: 2-(1,3-benzoxazol-2-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)CSc1nc2c(o1)cccc2

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Molecular Weight: 456.61
Empirical Formula: C28H28N2O2S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 8.4
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 71
Number of rings: 5

     

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