COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528008
Chemical Name: (5E)-1-hexyl-5-({[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCCCCCN1C(=O)NC(=O)/C(=C\NCC2N(C)CCc3c2c(OC)c2c(c3)OCO2)/C1=O

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Molecular Weight: 472.54
Empirical Formula: C24H32N4O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.04
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 109
Number of rings: 4

     

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