COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541373
Chemical Name: (11bS,13E)-13-(hydroxyimino)-9,10-dimethoxy-3,3-dimethyl-2,3,4,6,7,11b,12,13-octahydro-1H-isoquino[2,1-a]quinolin-1-one
Smiles: O/N=C/1\C[C@@H]2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc(OC)c(c1)OC

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Molecular Weight: 370.45
Empirical Formula: C21H26N2O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.493
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 4

     

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