COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552875
Chemical Name: 5-[(2,6-dimethylphenyl)carbamoyl]-4-methoxy-6,6-dimethyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Smiles: COc1c2OCOc2cc2c1C(C(=O)Nc1c(C)cccc1C)[N+](CC2)(C)C

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Saltdata: I-
Molecular Weight: 383.47
Empirical Formula: C22H27N2O4

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 0.369
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 56
Number of rings: 4

     

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