COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576071
Chemical Name: 16-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-3,3-dimethyl-2,3,4,6,7,11,12,16-octahydro-1H,10H-[1,4]dioxepino[2',3':6,7]isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc(cc2c1OCCO2)C1C=C2c3cc4OCCCOc4cc3CCN2C2=C1C(=O)CC(C2)(C)C

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Molecular Weight: 515.61
Empirical Formula: C31H33NO6

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 4.607
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 66
Number of rings: 7

     

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