COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK094924
Chemical Name: methyl2,7,7-trimethyl-5-oxo-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1OC)OC)C(=O)CC(C2)(C)C

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Molecular Weight: 415.49
Empirical Formula: C23H29NO6

Physical State: Dry powder
Available Amount: 177 mg

Lipinsky:
logP: 2.259
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 83
Number of rings: 3

     

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