COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK593604
Chemical Name: 4-(9,10-dimethoxy-3,3-dimethyl-1-oxo-2,3,4,6,7,13-hexahydro-1H-isoquino[2,1-a]quinolin-13-yl)-1,5-dimethyl-1H-pyrrole-2-carbonitrile
Smiles: COc1cc2CCN3C(=CC(C4=C3CC(C)(C)CC4=O)c3cc(n(c3C)C)C#N)c2cc1OC

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Molecular Weight: 457.57
Empirical Formula: C28H31N3O3

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 3.927
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 5

     

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