COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552972
Chemical Name: 5-[1-(diphenylmethyl)-1H-tetrazol-5-yl]-4-methoxy-6,6-dimethyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium
Smiles: COc1c2OCOc2cc2c1C(c1nnnn1C(c1ccccc1)c1ccccc1)[N+](CC2)(C)C

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Saltdata: I-
Molecular Weight: 470.55
Empirical Formula: C27H28N5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.151
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 71
Number of rings: 6

     

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