COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL532869
Chemical Name: 9,10-dimethoxy-13-(4-methoxyphenyl)-3,3-dimethyl-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: COc1ccc(cc1)C1C=C2c3cc(OC)c(cc3CCN2C2=C1C(=O)CC(C2)(C)C)OC

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Molecular Weight: 445.56
Empirical Formula: C28H31NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.834
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 48
Number of rings: 5

     

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