COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL523749
Chemical Name: (2,4-dimethoxyphenyl){4-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)sulfonyl]piperazin-1-yl}methanone
Smiles: COc1ccc(c(c1)OC)C(=O)N1CCN(CC1)S(=O)(=O)c1c2CCN(Cc2c(c2c1OCO2)OC)C

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Molecular Weight: 533.6
Empirical Formula: C25H31N3O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.777
Rotatable bonds: 5
H-donors: 0
H-acceptors: 8
PSA: 115
Number of rings: 5

     

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