COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK428780
Chemical Name: 2-(1,3-benzodioxol-5-yl)-N-{3-cyano-5-methyl-4-[4-(propan-2-yl)phenyl]thiophen-2-yl}quinoline-4-carboxamide
Smiles: N#Cc1c(NC(=O)c2cc(nc3c2cccc3)c2ccc3c(c2)OCO3)sc(c1c1ccc(cc1)C(C)C)C

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Molecular Weight: 531.63
Empirical Formula: C32H25N3O3S

Physical State: Dry powder
Available Amount: 535 mg

Lipinsky:
logP: 7.694
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 6

     

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