COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535345
Chemical Name: 6,7-dimethoxy-N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-1-phenyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: CSCC[C@@H](C(=O)N1CCCC1)NC(=O)N1CCc2c(C1c1ccccc1)cc(c(c2)OC)OC

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Molecular Weight: 497.66
Empirical Formula: C27H35N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.364
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 96
Number of rings: 4

     

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