COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK316295
Chemical Name: 2-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxo-4-(2,4,6-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1cc(OC)c(c(c1)OC)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)c1cc(ccc1Cl)C(F)(F)F)C#N

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Molecular Weight: 561.99
Empirical Formula: C28H27ClF3N3O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.181
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 97
Number of rings: 4

     

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