COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552987
Chemical Name: 4-methoxy-5-[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]-6,6-dimethyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Smiles: COc1c2OCOc2cc2c1C(c1nnnn1c1ccc(cc1)OC)[N+](CC2)(C)C

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Saltdata: I-
Molecular Weight: 410.45
Empirical Formula: C21H24N5O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.317
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 80
Number of rings: 5

     

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