COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438225
Chemical Name: 2-(3,4-dimethoxyphenyl)-N-{3-[({[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonyl}amino)methyl]-3,5,5-trimethylcyclohexyl}quinoline-4-carboxamide
Smiles: COc1cc(ccc1OC)c1nc2ccccc2c(c1)C(=O)NCC1(C)CC(NC(=O)c2cc(nc3c2cccc3)c2ccc(c(c2)OC)OC)CC(C1)(C)C

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Molecular Weight: 752.91
Empirical Formula: C46H48N4O6

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 7.528
Rotatable bonds: 11
H-donors: 2
H-acceptors: 6
PSA: 120
Number of rings: 7

     

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