COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL512443
Chemical Name: N,N'-bis(3,4-dimethoxybenzyl)-2-(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)propanediamide
Smiles: COc1cc(CNC(=O)/C(=C/2\NC(C)(C)Cc3c2cccc3)/C(=O)NCc2ccc(c(c2)OC)OC)ccc1OC

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Molecular Weight: 559.66
Empirical Formula: C32H37N3O6

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.513
Rotatable bonds: 10
H-donors: 3
H-acceptors: 6
PSA: 107
Number of rings: 4

     

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