COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK619313
Chemical Name: N-[(2S)-1-[(3-fluoro-4-methylphenyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(c(c1)F)C)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC

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Molecular Weight: 475.58
Empirical Formula: C24H30FN3O4S

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 4.818
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 105
Number of rings: 3

     

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