COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL174530
Chemical Name: 2-amino-1-(2-chloro-4-nitrophenyl)-4-{3-[(2,6-dimethylphenoxy)methyl]-4-methoxyphenyl}-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)COc1c(C)cccc1C)OC)C(=O)CC(C2)(C)C)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 613.11
Empirical Formula: C34H33ClN4O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.22
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 134
Number of rings: 5

     

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