COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598048
Chemical Name: 3-[(2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)acetyl]-N,N-dimethylbenzenesulfonamide
Smiles: COc1cc2CCN/C(=C\C(=O)c3cccc(c3)S(=O)(=O)N(C)C)/c2cc1OC

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Molecular Weight: 416.5
Empirical Formula: C21H24N2O5S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 2.907
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 3

     

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