COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK653830
Chemical Name: ethyl4-[4-(acetyloxy)phenyl]-5-hydroxy-2,7,7-trimethyl-4,6,7,8-tetrahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)OC(=O)C

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Molecular Weight: 397.47
Empirical Formula: C23H27NO5

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 4.007
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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