COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533717
Chemical Name: 14-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)-3,3-dimethyl-2,3,4,6,7,14-hexahydro-1H-[1,3]dioxolo[6,7]isoquino[2,1-a]quinolin-1-one
Smiles: COc1cc(cc2c1OCCO2)C1C=C2N(C3=C1C(=O)CC(C3)(C)C)CCc1c2cc2OCOc2c1

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Molecular Weight: 487.55
Empirical Formula: C29H29NO6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.501
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 66
Number of rings: 7

     

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